
Toxicology
Found 13565 products of "Toxicology"
Des(N-methoxycarbonyl)Velpatasvir
Controlled ProductFormula:C47H52N8O6Color and Shape:NeatMolecular weight:824.981,3-Dimethyl-1H-pyrazol-5-yl 2-(methylsulfonyl)-4-(trifluoromethyl) Benzoate
CAS:Controlled ProductFormula:C14H13F3N2O4SColor and Shape:NeatMolecular weight:362.324N-[(2,4-Difluorophenyl)methyl]-2,4-difluoro-benzenemethanamine
CAS:Controlled ProductApplications N-[(2,4-Difluorophenyl)methyl]-2,4-difluoro-benzenemethanamine is derived from 2,4-Difluorobenzylamine (D45085), which acts as a reagent for the design of pyrazole derivatives as non-nucleoside heptatitis B virus inhibitors. It is also used as a reagent in the preparation, HIV antiviral activity, SAR, and molecular modelling of hydroxypyridonecarboxylic acids as HIV reverse transcriptase inhibitors.
References Jia, H., et al.: Eur. J. Med. Chem., 123, 202 (2016); Kankanala, J., et al.: J. Med. Chem., 59, 5051 (2016)Formula:C14H11F4NColor and Shape:NeatMolecular weight:269.238Nitrofuraldehyde Diacetate Propionate
Controlled ProductFormula:C10H11NO7Color and Shape:NeatMolecular weight:257.197N-[(2,4-Difluorophenyl)methyl]-1,4-dihydro-5-hydroxy-4-oxo-3-pyridinecarboxamide
CAS:Controlled ProductFormula:C13H10F2N2O3Color and Shape:NeatMolecular weight:280.227Abacavir-1-O-pyrimidine Derivative
Controlled ProductFormula:C16H17Cl2N9O3Color and Shape:NeatMolecular weight:454.27Nevirapine Dimer
CAS:Controlled ProductImpurity Nevirapine EP Impurity D
Applications Nevirapine Dimer (Nevirapine EP Impurity D) is a dimeric impurity of the antiviral Nevirapine (N391275).Formula:C30H26N8O2Color and Shape:NeatMolecular weight:530.58(R)-4-Hydroxy-2-(3-methoxypropyl)-3,4-dihydro-2H-thieno[3,2-e][1,2]thiazine-6-sulfonamide 1,1-Dioxide
CAS:Controlled ProductFormula:C10H16N2O6S3Color and Shape:NeatMolecular weight:356.4393-Deschloro-3-p-toluidine Cefaclor
Controlled ProductFormula:C22H22N4O4SColor and Shape:NeatMolecular weight:438.56-epi-Ampicillin
CAS:Controlled ProductFormula:C16H19N3O4SColor and Shape:NeatMolecular weight:385.0863Sofosbuvir α-Isomer
Controlled ProductFormula:C22H29FN3O9PColor and Shape:NeatMolecular weight:529.4524-Bromo-3-(methoxymethoxy)pyridine
CAS:Controlled ProductFormula:C7H8BrNO2Color and Shape:NeatMolecular weight:482.514Avibactam Namido-sulfonyl Disodium Salt
Controlled ProductFormula:C7H9N3Na2O9S2Color and Shape:NeatMolecular weight:389.271Iso Ganciclovir Diacetate
CAS:Controlled ProductFormula:C13H17N5O6Color and Shape:NeatMolecular weight:339.3041,1-Dimethylethyl N-[(2-Oxo-3-azetidinyl)methyl]carbamate
CAS:Controlled ProductFormula:C9H16N2O3Color and Shape:NeatMolecular weight:200.2356β-Naltrexol 3-O-β-D-Glucuronide
CAS:Controlled ProductApplications A metabolite of 6β-Naltrexol (N285700). Narcotic antagonist.
References Portoghese, P. et al,: J. Med. Chem., 37, 579 (1994); Ohkawa, S., et al.: J. Med. Chem., 41, 4177 (1998);Formula:C26H33NO10Color and Shape:NeatMolecular weight:519.54Desfluoro Tedizolid Phosphate Ester
Controlled ProductFormula:C17H17N6O6PColor and Shape:NeatMolecular weight:432.327Des[3-[[(1-Carboxymethyl)cyclopropyl]methyl]thio]-2-propenyl Montelukast-d6 Mesylate
CAS:Controlled ProductFormula:C29D6H20ClNO·CH4O3SColor and Shape:NeatMolecular weight:542.119Emtricitabine Isopropyl Carbamate
Controlled ProductApplications Emtricitabine Isopropyl Carbamate is a derivative of Emtricitabine (E525000). Emtricitabine is a reverse transcriptase inhibitor. It is an effective antiviral agent against HIV, HBV, and other viruses replicating in a similar manner.
References FASEB J., 13, 1511 (1999), Molina, J.-M., et al.: J. InfecSchinazi, R.F., et al.: Antimicrob. Ag. Chemother., 36, 2423 (1992), Shockeor, J.P., et al.: Xenobioica, 26, 189 (1996), Feng, J.Y., et al.: . Dis., 182, 599 (2000)Formula:C12H16FN3O5SColor and Shape:NeatMolecular weight:333.336Allyloxy-3-oxo-2-((4-oxopentan-2-yl)amino)propyl)thio Cilastatin Derivative
Controlled ProductFormula:C27H42N2O6SColor and Shape:NeatMolecular weight:522.697Desdifluoro Dolutegravir
CAS:Controlled ProductFormula:C20H21N3O5Color and Shape:Off-WhiteMolecular weight:383.407-Acetamido-d3 Clonazepam
CAS:Controlled ProductApplications Labelled Clonazepam (C587080) metabolite.
References Huang, W., et al.: J. Anal. Toxicol., 19, 333 (1995), Rittner, M., et al.: J. Anal. Toxicol., 25, 115 (2001),Formula:C17H11D3ClN3O2Color and Shape:NeatMolecular weight:330.782,4,5-Trichlorobenzoyl Chloride
CAS:Controlled ProductFormula:C7H2Cl4OColor and Shape:NeatMolecular weight:243.902N5-Hydroxylamino Caspofungin
CAS:Controlled ProductFormula:C52H88N10O16·C2H4O2Color and Shape:NeatMolecular weight:1169.36(R)-2-((4-Chlorophenyl)(piperidin-4-yloxy)methyl)pyridine
CAS:Controlled ProductFormula:C17H19ClN2OColor and Shape:NeatMolecular weight:302.799Cefotetan
CAS:Controlled ProductStability Hygroscopic
Applications An antibiotic related to Cephalosporin, used in the treatment of bacterial infections.
References Ahmed, A., et al.: Vet. Microbiol., 136, 397 (2009), Kim, M., et al.: J. Bacteriol. Virol., 39, 29 (2009), Fourches, D., et al.: Chem. Res. Toxicol., 23, 171 (2010),Formula:C17H17N7O8S4Color and Shape:White To Light YellowMolecular weight:575.62Piperacillin Sulfone Sodium Salt
Controlled ProductFormula:C23H26N5NaO9SColor and Shape:NeatMolecular weight:571.5354-(5-Bromothiophen-2-yl)benzonitrile
CAS:Controlled ProductApplications 4-(5-Bromothiophen-2-yl)benzonitrile (CAS# 415718-60-4) is a useful research chemical compound.
Formula:C11H6BrNSColor and Shape:NeatMolecular weight:264.141-(2,2-Dimethoxyethyl)-1,4-dihydro-4-oxo-2,5-pyridinedicarboxylic Acid 2,5-Diethyl Ester
CAS:Controlled ProductFormula:C15H21NO7Color and Shape:NeatMolecular weight:327.33(4R,12aS)-7-Bromo-3,4,6,8,12,12a-hexahydro-4-methyl-6,8-dioxo-2H-pyrido[1',2':4,5]pyrazino[2,1-b][1,3]oxazine-9-carboxylic Acid Ethyl Ester
CAS:Controlled ProductFormula:C15H17BrN2O5Color and Shape:NeatMolecular weight:385.218-[(Hexahydro-1H-1,4-diazepin-1-yl)sulfonyl]isoquinoline
CAS:Controlled ProductFormula:C14H17N3O2SColor and Shape:NeatMolecular weight:291.3693’-O-Benzyl Sofosbuvir Desphosphate
Controlled ProductApplications 3’-O-Benzyl Sofosbuvir Desphosphate may be a metabolite of Sofosbuvir (P839640), a prodrug that is metabolized to the active antiviral agent 2'-deoxy-2'-α-fluoro-β-C-methyluridine-5'-monophosphate and is currently being investigated in phase 3 clinical trials for the treatment of hepatitis C. Studies have profiled PSI-7977 as a nucleotide inhibitor of hepatitis C virus, exerting selective inhibitory effects towards HCV NS5B polymerase.
References Lam, A.M.,et al.: Antimicrob. Agents. Chemotherapy., 56, 3359 (2012); Lam, A.M., et al.: J. Virol., 85, 12334 (2011); Sofia, M.J., et al.: J. Medn. Chem., 53, 7202 (2010);Formula:C17H19FN2O5Color and Shape:NeatMolecular weight:350.35Des-(2-butyl) N-Allyl Itraconazole
CAS:Controlled ProductFormula:C34H34Cl2N8O4Color and Shape:NeatMolecular weight:689.591(2R,4R)-trans-Ketoconazole
CAS:Controlled ProductFormula:C26H28Cl2N4O4Color and Shape:NeatMolecular weight:531.431Desphenol 1-Hydroxyethyl Cefoperazone Furolactone
CAS:Controlled ProductFormula:C20H25N5O9SColor and Shape:NeatMolecular weight:511.506Bisphenol AP Mono-β-D-glucuronide Sodium
Controlled ProductApplications Bisphenol AP Mono-β-D-glucuronide is a metabolite of Bisphenol AP (B519485), which is used to prepare triphenylmethane derivatives as inhibitors of hepatitis C virus helicase. Bisphenol AP is a derivative of Bisphenol A (B519495) which is a monomer used for policarbonate and epoxy resins.
References Krishnan, A.V., et al.: Endocrinology, 132, 2279 (1993); Steinmetz, R., et al.: Trends Endocrinol. Metab., 9, 124 (1998); Petersen, H., et al.: Eur. Food Res. Technol., 216, 355 (2003); Chen, C., et al.: J. Med. Chem., 52, 2716 (2009);Formula:C26H25O8·NaColor and Shape:NeatMolecular weight:466.48(3R,8S,9S,12S)-Atazanavir
CAS:Controlled ProductFormula:C38H52N6O7Color and Shape:NeatMolecular weight:704.856Sofosbuvir O-Desisopropyl O-Methyl Ester
CAS:Controlled ProductFormula:C20H25FN3O9PColor and Shape:NeatMolecular weight:501.399o-Carbomethoxybenzyl Sulfonamide
CAS:Controlled ProductApplications o-Carbomethoxybenzyl Sulfonamide is a useful reactant in organic synthesis.
References Jiang, Lin, et al.: Youji Huaxue, 26(2), 203-206 (2006)Formula:C9H11NO4SColor and Shape:NeatMolecular weight:229.25Linezolid Dimer
CAS:Controlled ProductFormula:C30H35F2N5O7Color and Shape:NeatMolecular weight:615.6212b-Deoxycholic Acid Methyl Ester 3a-Benzoate
Controlled ProductApplications 12β-Deoxycholic Acid Methyl Ester 3α-Benzoate is an intermediate in the synthesis of 3α,12β-Dihydroxycholanoic Acid is a bile acid that may decrease of the toxic effects of deoxycholic acid on lipid peroxidn.
References Hino, A., et. al.: J. Biochem., 129, 683 (2001)Formula:C32H46O5Color and Shape:NeatMolecular weight:510.715β-Hydroxytestosterone
CAS:Controlled ProductFormula:C19H28O3Color and Shape:NeatMolecular weight:304.4246-Alkylamino Famciclovir
Controlled ProductFormula:C23H34N6O8Color and Shape:NeatMolecular weight:522.555-Methoxy Dapagliflozin Tetraacetate
CAS:Controlled ProductApplications 5-Methoxy Dapagliflozin Tetraacetate is an intermediate in the synthesis of (1S)-1,5-anhydro-1-C-[4-Chloro-3-[(4-ethoxyphenyl)hydroxymethyl]phenyl]-D-glucitol (A638185) which is an impurity of the drug Dapagliflozin (D185370), a sodium-glucose transporter 2 inhibitor.
References Kasichayanula, S. et al.: Diabetes, Obesity and Metabolism 13, 47 (2011)Formula:C29H31ClO11Color and Shape:NeatMolecular weight:591.003Benzyl ((2R,3R)-4-Chloro-3-hydroxy-1-(phenylsulfinyl)butan-2-yl)carbamate
Controlled ProductFormula:C18H20ClNO4SColor and Shape:NeatMolecular weight:381.874(3R,8R,9S,12R)-Atazanavir
CAS:Controlled ProductFormula:C38H52N6O7Color and Shape:NeatMolecular weight:704.856(3β)-3-[[(1,1-Dimethylethyl)dimethylsilyl]oxy]olean-12-en-28-al
CAS:Controlled ProductFormula:C36H62O2SiColor and Shape:NeatMolecular weight:554.962(R)-Ofloxacin Carboxylic Acid (Dextrofloxacin Difluoro Impurity)
CAS:Controlled ProductFormula:C13H9F2NO4Color and Shape:NeatMolecular weight:281.216-Defluoro-(ethoxycarbonyl)piperazinyl-7-depiperazinyl-chloro Norfloxacin
Controlled ProductFormula:C19H22ClN3O4Color and Shape:NeatMolecular weight:362.79Cerulenin (Synthetic)
CAS:Controlled ProductFormula:C12H17NO3Color and Shape:NeatMolecular weight:223.268Tazobactam Ethyl Ester
Controlled ProductFormula:C12H16N4O5SColor and Shape:NeatMolecular weight:328.344Remdesivir 5’-Desphosphate 2’-O-[(S)phosphate]
CAS:Controlled ProductFormula:C27H35N6O8PColor and Shape:NeatMolecular weight:605.602-(Diethylamino)ethyl 4-[[2-(phenylmethoxy)benzoyl]amino]benzoate
CAS:Controlled ProductFormula:C27H30N2O4Color and Shape:NeatMolecular weight:446.5384-Carboxy Levamisole
CAS:Controlled ProductFormula:C12H12N2O2SColor and Shape:NeatMolecular weight:248.32-Hydroxy Desipramine-d3 β-D-Glucuronide
CAS:Controlled ProductFormula:C24D3H27N2O7Color and Shape:NeatMolecular weight:461.5234-Amino-1-(10-phthalimidodecyl)quinaldinium Iodide
CAS:Controlled ProductApplications 4-Amino-1-(10-phthalimidodecyl)quinaldinium Iodide is an intermediate for the synthesis of 4-Amino-1-[10-[(2-methyl-4-quinolyl)amino]decyl]quinaldinium Iodide Hydriodide (M493250), which is an impurity of Dequalinium (D288335); the active ingredient in various medications including antiseptic and anti-malarial agents.
References Kunisada, Y., et al.: J. Biomolec. Screen., 17, 140 (2012); Zeder-Lutz., G., et al.: Anal. Biochem., 421, 417 (2012)Formula:C28H34N3O2·IColor and Shape:NeatMolecular weight:571.493(4-Benzylpiperidin-4-yl)methanol Hydrochloride
CAS:Controlled ProductFormula:C13H19NO•HClColor and Shape:NeatMolecular weight:241.762-[(1R,2R)-1-Ethyl-2-(phenylmethoxy)propyl]hydrazinecarboxaldehyde
CAS:Controlled ProductFormula:C13H20N2O2Color and Shape:NeatMolecular weight:236.311-(3-Methylphenyl)cyclopropanecarboxylic Acid
CAS:Controlled ProductFormula:C11H12O2Color and Shape:NeatMolecular weight:176.212Cyclosporin D-d4
CAS:Controlled ProductFormula:C63H109D4N11O12Color and Shape:NeatMolecular weight:1220.69Desthiazoximic Acid Ceftiofur (>85%)
CAS:Controlled ProductApplications Ceftiofur intermediate.
Formula:C13H12N2O5S2Purity:>85%Color and Shape:NeatMolecular weight:340.37Methyl 2-((((Benzyloxy)carbonyl)amino)methyl)-5-hydroxy-6-oxo-1,6-dihydropyrimidine-4-carboxylate
Controlled ProductApplications Methyl 2-((((Benzyloxy)carbonyl)amino)methyl)-5-hydroxy-6-oxo-1,6-dihydropyrimidine-4-carboxylate is an intermediate used in the synthesis of N-((5-Hydroxy-6-oxo-4-((2,4,6-trifluorobenzyl)carbamoyl)-1,6-dihydropyrimidin-2-yl)methyl)-1,3,4-oxadiazole-2-carboxamide (H950690), which is a derivative of Raltegravir (R100305), a potent integrase (IN) inhibitor for WT and S217Q PFV IN.
References Hare, S., et al.: Proc. Natl. Acad. Sci. U. S. A., 107, 20057 (2010); Hicks, C., et al.: Clin. Infect. Dis., 48, 931 (2009); Moss, D., et al.: Antimicrob. Agents Chemother., 56, 3020 (2012); Hare, S., et al.: Mol. Pharmacol., 80, 565 (2011)Formula:C15H15N3O6Color and Shape:NeatMolecular weight:333.2963'-Deoxyadenosine 5’-(3-Methyl-1-phosphono-1H-imidazol-3-ium)
Controlled ProductFormula:C14H19N7O5PColor and Shape:NeatMolecular weight:396.3182-Hydroxy-2’-oxymoxifloxacin
Controlled ProductFormula:C21H22FN3O6Color and Shape:NeatMolecular weight:431.414Atorvastatin Acyl-b-D-glucuronide
CAS:Controlled ProductFormula:C39H43FN2O11Color and Shape:NeatMolecular weight:734.767-Fluoro-5-methyl-1H-indazole
CAS:Controlled ProductFormula:C8H7FN2Color and Shape:NeatMolecular weight:150.1535,5-Dimethyl-2-oxazolidinone
CAS:Controlled ProductFormula:C5H9NO2Color and Shape:NeatMolecular weight:115.13(4-Benzyl-1-methylpiperidin-4-yl)methanol Hydrochloride
CAS:Controlled ProductFormula:C14H21NO•HClColor and Shape:NeatMolecular weight:255.79SN-38 Carboxylate Disodium Salt
CAS:Controlled ProductApplications The active metabolite of Irinotecan (carboxylate form). SN-38 lactone and carboxylate may be considered pharmacokinetically distinct agents.
References Billecke, S., et al.: Drug Metab. Dispos., 28, 1335 (2000), Teiber, J., et al.: Biochem. Pharmacol., 66, 887 (2003), Ashley, G., et al.: J. Antibiot., 57, 224 (2004),Formula:C22H20N2Na2O6Color and Shape:NeatMolecular weight:454.39Zinc Salicylate Hydrate
CAS:Applications Zinc salicylate trihydrate (CAS# 16283-36-6) is a useful research chemical compound.
Formula:C14H10O6Zn·2H2OColor and Shape:NeatMolecular weight:375.665Des(N-methoxycarbonyl)-L-valine) Velpatasvir
Controlled ProductFormula:C42H43N7O5Color and Shape:NeatMolecular weight:725.83Dibromomethylene Bisphosphonic Acid Tri(dicyclohexylammonium Salt)
CAS:Controlled ProductFormula:C12H23N·CH4Br2O6P2Color and Shape:NeatMolecular weight:877.747Ceftiofur Isobutyl Acetate
Controlled ProductFormula:C24H25N5O9S3Color and Shape:NeatMolecular weight:623.6783-Morpholinecarboxamide
CAS:Controlled ProductFormula:C5H10N2O2Color and Shape:NeatMolecular weight:130.145N-Ethoxycarbonyl-ciprofloxacin
CAS:Controlled ProductFormula:C20H22FN3O5Color and Shape:NeatMolecular weight:403.403,4'-Diacetyldiphenyl Oxide
CAS:Controlled ProductFormula:C16H14O3Color and Shape:NeatMolecular weight:254.281N-Methyl Rifampicin
Controlled ProductFormula:C44H62N4O12Color and Shape:NeatMolecular weight:838.983(3S)-10-(4-Ethyl-1-piperazinyl)-9-fluoro-2,3-dihydro-3-methyl-7-oxo-7H-pyrido[1,2,3-de]-1,4-benzoxazine-6-carboxylic Acid(Levofloxacin Impurity)
CAS:Controlled ProductFormula:C19H22FN3O4Color and Shape:NeatMolecular weight:375.394Des-alanyl Sofosbuvir
CAS:Controlled ProductFormula:C16H18FN2O8PColor and Shape:NeatMolecular weight:416.296-Defluoro-piperazinyl 6-(4-(tert-Butoxycarbonyl)piperazin-1-yl)-chloro Norfloxacin
Controlled ProductFormula:C21H26ClN3O5Color and Shape:NeatMolecular weight:435.9012,2,5,5-Tetramethyl-4-thiazolidinecarboxylic Acid
CAS:Controlled ProductFormula:C8H15NO2SColor and Shape:NeatMolecular weight:189.275E-Oximinoarylsulfonamide
CAS:Controlled ProductFormula:C34H46N6O6S2Color and Shape:NeatMolecular weight:698.896Rilpivirine Amide
CAS:Controlled ProductFormula:C22H20N6OColor and Shape:Off-WhiteMolecular weight:384.434Famoxadone
CAS:Controlled ProductApplications Famoxadone is a known fungicide used in the protection of agricultural products against various fungal diseases and other biotic stresses such as pests.
Not a dangerous good if item is equal to or less than 1g/ml and there is less than 100g/ml in the package
References Speck- Planche, A., et al.: Excotoxicol. Enviro. Safety., 80. 308 (2012).Formula:C22H18N2O4Color and Shape:Light BeigeMolecular weight:374.39Thio-oxy Fluoro Fluticasone Furoate
CAS:Controlled ProductFormula:C27H29F3O7SColor and Shape:NeatMolecular weight:554.575Ritonavir Impurity R
Controlled ProductFormula:C37H48N6O5S2Color and Shape:NeatMolecular weight:720.9446-Amino Didesacetyl Famciclovir
CAS:Controlled ProductFormula:C10H16N6O2Color and Shape:NeatMolecular weight:252.273N-Boc Gatifloxacin N-Oxide
Controlled ProductApplications N-Boc Gatifloxacin N-Oxide is an intermediate used in the synthesis of Gatifloxacin N-Oxide (G250005), which is an impurity of Gatifloxacin (G250000), an antibacterial agent.
References Bauernfeind, A.: J. Antimicro. Chemother., 40, 639 (1997), Fukuda, H., et al.: Antimicrob. Ag. Chemother., 42, 1917 (1998),Formula:C24H30FN3O7Color and Shape:NeatMolecular weight:491.509Cefixime tert-Butyl Ester
CAS:Controlled ProductFormula:C20H23N5O7S2Color and Shape:NeatMolecular weight:509.556di-Val-L-dC Trihydrochloride
CAS:Controlled ProductApplications di-Val-L-dC Trihydrochloride is a β-L-2'-Deoxynucleoside for treatment of resistant hepatitis B virus strains, and combination therapies.
References Standring, D. et al.: PCT Int. Appl. (2004)Formula:C19H31N5O6•3HClColor and Shape:NeatMolecular weight:425.48 + 3(36.46)(R)-8,14-Dihydroxy Efavirenz
Controlled ProductFormula:C14H9ClF3NO4Color and Shape:NeatMolecular weight:347.674Diethyl 1,5-Dimethyl-3-phenylpyrrole-2,4-dicarboxylate
CAS:Controlled ProductFormula:C18H21NO4Color and Shape:NeatMolecular weight:315.364tert-Butyl 4-Hydroxy-2,6-dioxotetrahydro-2H-pyran-4-carboxylate
CAS:Controlled ProductFormula:C10H14O6Color and Shape:NeatMolecular weight:230.215
