Building Blocks

Versatile small molecule scaffold

Versatile small molecule scaffold

Versatile small molecule scaffold

Versatile small molecule scaffold

Versatile small molecule scaffold

2-Ethylpyridin-4-amine is a pyridine that can be synthesized from the amination of 4-nitrophenol. It can also be synthesized by acylation of 2-ethylpyridine with ethyl chloroformate followed by cyclization. This compound has shown to have high yields in reactions involving pyridines and it is often used as a precursor for other compounds.

Versatile small molecule scaffold

5-Phenyl-1H-pyrazin-2-one is a potent inhibitor of tyrosine kinase, which is an enzyme that regulates the activity of cells by transferring phosphate groups from ATP to tyrosine residues. This drug binds to the ATP binding site, resulting in inhibition of the enzyme's activity and reduced cell proliferation. 5-Phenyl-1H-pyrazin-2-one has been shown to be effective in treating rheumatoid arthritis and other autoimmune diseases, with no adverse effects on bone metabolism or blood pressure. It also has no effect on platelet aggregation or erythrocytes.

Versatile small molecule scaffold

3,5-Dichlorophthalic acid is a divalent organic acid that is used as an intermediate in the production of other chemicals. 3,5-Dichlorophthalic acid is used as a regulator of plant growth and development. It can also be used to make different n-substituted compounds, such as naphthalene, phthalic anhydride, and 2,6-dichloro-pyridine.

Versatile small molecule scaffold

(3,3,3-Trifluoroprop-1-yn-1-yl)benzene is a reaction product that can be used to inhibit the activity of metalloprotease and as an anti-cancer agent. This compound inhibits the enzyme that causes chronic kidney disease and degenerative diseases. It is a potent inhibitor of metalloprotease, which is involved in cancer progression, fatty acid synthesis and bone formation. The effective dose for this drug is between 1 and 10mg/kg body weight. It has been shown to have an asymmetric synthesis with the use of amido groups. (3,3,3-Trifluoroprop-1-yn-1-yl)benzene also has antirheumatic properties due to its ability to inhibit proteases such as matrix metalloproteinases and cathepsins.

Versatile small molecule scaffold

1,2,3,4,5-Pentachlorobenzene is a chlorinated hydrocarbon that is used in the production of pesticides and herbicides. It is an ingredient in the manufacturing of pentachlorophenol and pentachloronitrobenzene. 1,2,3,4,5-Pentachlorobenzene has been used as a chemical intermediate or solvent for the production of other chemicals. The emissions from this chemical can be harmful to humans and animals because it has been shown to affect enzyme activities at sublethal doses. It also affects rat liver microsomes and causes DNA damage that can lead to cancer.

2,2-Dibromopropane is a synthetic chemical that has been used as a precursor in the production of nylon. It is an activator that can be used to form covalent bonds with reactive groups on other molecules. The activation energy for the reaction with piperazine is between 104 and 106 kJ/mol. 2,2-Dibromopropane undergoes acylation reactions under certain conditions, forming reaction products such as 2,2-dibromoethyl acetate and 2,2-dibromoethanol. The molecular weight of 2,2-dibromopropane is 192.19 g/mol and its structural formula is CHBrCHBrCHBrCHBrC≡C≡C≡C≡C≡C≡CC(O)OH.

Versatile small molecule scaffold

1-Monotetranoin is a fatty ester that is involved in the process of lipolysis, which is the breakdown of fat cells. Lipolysis occurs when an enzyme called lipase hydrolyzes triglycerides into glycerol and three fatty acids. 1-Monotetranoin has been shown to be a potent stimulator of growth factor production and cell proliferation in vivo models. It has also been shown to be effective at inhibiting angiogenic processes in vitro, including the release of growth factors from fat cells. The neutral pH optimum for 1-monotetranoin is between 7 and 8, which may be due to its hydrophobic nature.

1,2-Diethylbenzene is a trifluoroacetic acid derivative that is used as an acylation agent and a solid catalyst. 1,2-Diethylbenzene has been shown to increase the energy metabolism in cultured human cells. It also influences fatty acid synthesis and nmr spectra of plant families. 1,2-Diethylbenzene was found to be safe for use in sciatic nerve regeneration in Sprague-Dawley rats with axonopathy. This chemical can also be used as an analytical reagent for the separation of urine samples by liquid chromatography methods.

4'-(Methylsulfonyl)acetanilide is an organic compound that has been shown to have antibacterial and antiviral activity. It targets the benzene nucleus, and inhibits the synthesis of nucleic acids by inhibiting the enzyme ribonucleotide reductase. 4'-(Methylsulfonyl)acetanilide also inhibits viral replication, by binding to the active site of a viral protein (a DNA polymerase), which blocks the incorporation of nucleotides into the virus's DNA. In addition, 4'-(methylsulfonyl)acetanilide is an anti-helminthic agent, as it can inhibit worm motility and kill larvae in vitro. The structure-activity relationships between this molecule and other benzimidazole derivatives were analysed in order to identify new potential drugs for treating diseases caused by viruses or parasites.

Versatile small molecule scaffold

3-(4-Nitrophenoxy)propionic acid is a promiscuous compound that can be used to synthesize other compounds. It reacts with hydrochloric acid, nitro groups, and phosphorus pentoxide to produce nitro compounds. 3-(4-Nitrophenoxy)propionic acid reacts with benzoylamine in the presence of a cocatalyst to form alkoxycarbonyl products. The cocatalyst is typically a metal such as zinc or magnesium. 3-(4-Nitrophenoxy)propionic acid is also used as an agrochemical for controlling influenza virus and Influenzae bacteria.
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Versatile small molecule scaffold

Versatile small molecule scaffold

Versatile small molecule scaffold

2-[(3,5-Dimethylphenyl)formamido]acetic acid is a compound with diverse applications and characteristics. It is a diphenyl ether that can be used as an electrode material in various electronic devices. Additionally, it has cholinergic properties, meaning it affects the neurotransmitter acetylcholine in the nervous system.

Versatile small molecule scaffold

Versatile small molecule scaffold

Versatile small molecule scaffold

Versatile small molecule scaffold

Versatile small molecule scaffold

Versatile small molecule scaffold

Versatile small molecule scaffold

Versatile small molecule scaffold

Versatile small molecule scaffold

Versatile small molecule scaffold

Versatile small molecule scaffold

2-Chloro-9H-carbazole (2CzC) is a heterocyclic compound that belongs to the group of carbazoles. It can be used as medicine and has been shown to be a good control experiment for other carbazoles. The nucleophilicity of 2CzC is affected by the functional groups present in the molecule, and it has been shown to react with anions such as Cl-, Br-, or I-. This heterocycle also has two resonance forms, which are generated by the electron delocalization in the ring system. The gas phase kinetics of 2CzC have been found to follow an Arrhenius relationship, with k = 3.6x10^3 M^-1 s^-1 at 298 K. Yields for this compound have been found to be high, with 90% yield when synthesized from chloroacetone and phenylmagnesium bromide.

Versatile small molecule scaffold

Versatile small molecule scaffold

Versatile small molecule scaffold

Versatile small molecule scaffold

Versatile small molecule scaffold

Versatile small molecule scaffold

Versatile small molecule scaffold

2-Methyl-2-phenylmorpholine is an industrial chemical that has a c1-c4 alkyl group. It can be used in the production of antidepressants, such as Tofranil, and other drugs. 2-Methyl-2-phenylmorpholine is also used in the industrial production of polymers.

Versatile small molecule scaffold

Versatile small molecule scaffold

Piperazine-2-carboxamide is a synthetic drug that is used to treat tuberculosis. It binds to the mycolic acid of the bacterial cell wall, preventing it from forming an outer layer and disrupting its function. Piperazine-2-carboxamide also inhibits the synthesis of fatty acids and amines in bacteria, which are necessary for their survival. This drug can be synthesized by reacting piperazine with formaldehyde and acetamide.

Versatile small molecule scaffold

Versatile small molecule scaffold

Versatile small molecule scaffold

Versatile small molecule scaffold

Versatile small molecule scaffold

Versatile small molecule scaffold

Versatile small molecule scaffold

1-Hydroxycyclopentane-1-carbonitrile is a monomer that is hydrolyzed to form benzoin and cyanohydrins. It can be used in the production of scifinder as a monomer or dimerizer.

2-Bromo-3,3,3-trifluoro-1-propene is a chemical compound that has been synthesized in an asymmetric reaction. The reactant is bromopropane and the product is 2,2,2-trifluoropropene. The methylene group on the propene molecule is activated by the nucleophilic attack of a fluoride ion from hydrogen fluoride to form a cavity with a highly strained bond. The kinetic study of this reaction revealed that the activation energy for the reaction is 42 kJ/mol. Palladium-catalyzed coupling reactions are catalyzed by palladium and require nonpolar solvents such as toluene or dichloromethane. This type of reaction has been shown to be exothermic with an isolated yield of 1%.

Versatile small molecule scaffold

3-Hydroxy-5-methylpyridine (3HMP) is a chemical substance that has been classified as an amine. It is a product of the metabolism of purines, which are nitrogenous bases found in DNA and RNA. 3HMP is produced by aerogenic bacteria (such as Enterobacter), and can be used to estimate the number of these bacteria present in water samples. 3HMP has been shown to have antiviral properties against influenza virus, and can be used as a biomarker for the presence of other viruses in animals. 3HMP also has mineralization properties, which have been studied extensively, particularly with regards to pancreatic disease.

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4,5-Dihydroxy-2,3-pentanedione is a carbonyl compound that is the product of the oxidation of ascorbic acid. It is used in wastewater treatment and has antimicrobial properties against infectious diseases. This compound has been shown to inhibit protein synthesis by binding to the ribosome and preventing the formation of peptide bonds between amino acids. 4,5-Dihydroxy-2,3-pentanedione has also been shown to bind to plasma proteins, which may be due to its acyl chain structure. 4,5-Dihydroxy-2,3-pentanedione can be synthesized in a catalytic mechanism that involves dehydroascorbic acid and molecular oxygen.

Piperyline is an alkanoic acid that has shown to be effective against skin cancer. It also has antimicrobial properties, which may be due to its ability to bind metal ions and form polymeric compounds. Piperyline inhibits microbial growth by inhibiting the synthesis of proteins and nucleic acids. The antimicrobial activity is related to its cationic polymerization with hydroxyl groups, which forms a structure that can inhibit microbial enzymes and disrupt microbial cell membranes. This compound also interacts with the skin's natural lipids, making it difficult for microorganisms to attach and grow on the skin. Piperyline is synthesized in organic chemistry laboratories as an amide precursor of other pharmaceuticals such as penicillin.