CAS 400827-64-7

7β-amino-3-[4-pyridyl-2-thiazole sulfur radical]-3-cephem-4-carboxylic acid・2HCl

Description:

7β-amino-3-[4-pyridyl-2-thiazole sulfur radical]-3-cephem-4-carboxylic acid, with the CAS number 400827-64-7, is a synthetic compound belonging to the cephem class of antibiotics, which are characterized by their β-lactam structure. This compound features a thiazole moiety and a pyridine ring, contributing to its unique pharmacological properties. The presence of the amino group at the 7β position enhances its antibacterial activity by facilitating interactions with bacterial cell wall synthesis enzymes. The carboxylic acid group at the 4 position is crucial for solubility and bioactivity. As a hydrochloride salt (indicated by the 2HCl), it is likely to exhibit improved stability and solubility in aqueous environments, making it suitable for pharmaceutical formulations. The compound's structure suggests potential efficacy against a range of Gram-positive and Gram-negative bacteria, although specific activity would depend on further empirical studies. Overall, this compound represents a novel approach in antibiotic development, particularly in the context of combating antibiotic resistance.

Formula: C₁₆H₁₆Cl₂N₄O₃S₃

InChI: InChI=1S/C16H14N4O3S3.2ClH/c1-19-4-2-8(3-5-19)9-6-25-16(18-9)26-10-7-24-14-11(17)13(21)20(14)12(10)15(22)23;;/h2-6,11,14H,7,17H2,1H3;2*1H/t11-,14-;;/m1../s1

InChI key: InChIKey=SCEMEDZWEIWQPU-WGSPLUPMSA-N

SMILES: C(O)(=O)C=1N2[C@@]([C@H](N)C2=O)(SCC1SC3=NC(=CS3)C=4C=C[N+](C)=CC4)[H].[Cl-].Cl

Synonyms:

• Pyridinium, 4-[2-[[(6R,7R)-7-amino-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]thio]-4-thiazolyl]-1-methyl-, chloride, monohydrochloride
• Pyridinium,4-[2-[[(6R,7R)-7-amino-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]thio]-4-thiazolyl]-1-methyl-,chloride,hydrochloride(1:1:1)
• Pyridinium,4-[2-[[(6R,7R)-7-amino-2-carboxy-8-oxo-5-thia-1-
• 7 β - aMino - 3 - [4 - pyridyl - 2 - thiazole sulfur radical ] - 3 - cepheM - 4 - carboxylic aci
• 4-(2-(((6R,7R)-7-Amino-2-carboxy-8-oxo-5-thia-1-azabicycL
• Ceftaroline mother core (dihydrochloride)
• 7β-amino-3-[4-pyridyl-2-thiazole-thio]-3-cephem-4-carboxylic acid dihydrochloride
• azabicyclo[4.2.0]oct-2-en-3-yl]thio]-4-thiazolyl]-1-methyl-
• Ceftaroline mainchain
• pyridin-1-ium chL
• o[4.2.0]oct-2-en-3-yL
• ,chloride, hydrochloride (1:1:1)
• 7 β - aMino - 3 - [4 - pyridyl - 2 - thiazole sulfur radical ] - 3 - cepheM - 4 - carboxylic acid ·2HC
• eleven β- [4 - (n, N-dimethylamino) - phenyl] - 17 α- Hydroxy-19-norgestrol-4,9-diene-3,20-dione
• 7 β - aMino - 3 - [4 - pyridyl - 2 - thiazole sulfur radical ] - 3 - cepheM
• 7 β - aMino - 3 - [4 - pyridyl - 2 - thiazole sulfur radical ] - 3 - cepheM - 4 - carboxylic acid ·2HCl
• 4-[2-[[(6R,7R)-7-Amino-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]thio]-4-thiazolyl]-1-methyl-pyridinium chloride monohydrochloride
• 4-(2-(((6R,7R)-7-Amino-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl)thio)thiazol-4-yl)-1-methylpyridin-1-ium chloride hydrochloride
• 7R)-7-Amino-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]thio]-4-thiazolyl]-1-methyl-pyridinium chloride monohydrochloride

Pyridinium,4-[2-[[(6R,7R)-7-amino-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]thio]-4-thiazolyl]-1-methyl-, chloride, monohydrochloride

CAS: 400827-64-7

Formula: C₁₆H₁₆Cl₂N₄O₃S₃

Purity: 97%

Color and Shape: Solid

Molecular weight: 479.4242

Ref: IN-DA00CKNE

4-(2-(((6R,7R)-7-Amino-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl)thio)thiazol-4-yl)-1-methylpyridin-1-ium chloride hydrochloride

CAS: 400827-64-7

4-(2-(((6R,7R)-7-Amino-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl)thio)thiazol-4-yl)-1-methylpyridin-1-ium chloride hydrochloride

Purity: 97%

Molecular weight: 479.44g/mol

Ref: 54-OR1068797

4-(2-(((6R,7R)-7-Amino-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl)thio)thiazol-4-yl)-1-methylpyridin-1-ium chloride hydrochloride

CAS: 400827-64-7

Purity: 97%

Molecular weight: 479.4100037

Ref: 10-F690798

4-[2-[[(6R,7R)-7-Amino-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]thio]-4-thiazolyl]-1-methyl-pyridinium Chloride Monoh ydrochloride

CAS: 400827-64-7

4-[2-[[(6R,7R)-7-Amino-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]thio]-4-thiazolyl]-1-methylpyridinium Chloride Monohydrochloride is a drug product under development for the treatment of bacterial infections. 4-[2-[(6R,7R)-7Amino--2carboxy8oxo5thia1azabicyclo[4.2.0]oct2en3yl]thio]-4thiazolyl]-1methylpyridinium Chloride Monohydrochloride is an impurity in the API Methicillin (CAS No. 40082764). Impurities are not necessarily undesirable and may have substantial therapeutic value or provide a desired

Formula: C₁₆H₁₅N₄O₃S₃·Cl·HCl

Purity: Min. 95%

Molecular weight: 479.43 g/mol

Ref: 3D-IA172859