CAS 115850-11-8: 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 3-[[(5-methyl-1,3,4-thiadiazol-2-yl)thio]methyl]-8-oxo-7-[[2-(1H-tetrazol-1-yl)acetyl]amino]-, sodium salt, hydrate (1:1:5), (6R,7R)-

Description: 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 3-[[(5-methyl-1,3,4-thiadiazol-2-yl)thio]methyl]-8-oxo-7-[[2-(1H-tetrazol-1-yl)acetyl]amino]-, sodium salt, hydrate (1:1:5), (6R,7R)- is a complex chemical compound characterized by its bicyclic structure, which includes both sulfur and nitrogen atoms in its framework. This compound features a carboxylic acid functional group, contributing to its acidic properties, and is further modified with various substituents that enhance its biological activity. The presence of a sodium salt form indicates its solubility in water, which is crucial for its potential applications in pharmaceuticals. The compound's stereochemistry, denoted by the (6R,7R) configuration, suggests specific spatial arrangements that may influence its interaction with biological targets. Additionally, the incorporation of thiadiazole and tetrazole moieties suggests potential antimicrobial or antifungal properties, making it of interest in medicinal chemistry. Overall, this compound exemplifies the intricate design often found in bioactive molecules, combining multiple functional groups and structural features for enhanced efficacy.

Formula: C₁₄H₁₄N₈O₄S₃·5H₂O·Na

InChI: InChI=1S/C14H14N8O4S3.Na.5H2O/c1-6-17-18-14(29-6)28-4-7-3-27-12-9(11(24)22(12)10(7)13(25)26)16-8(23)2-21-5-15-19-20-21;;;;;;/h5,9,12H,2-4H2,1H3,(H,16,23)(H,25,26);;5*1H2/t9-,12-;;;;;;/m1....../s1

InChI key: InChIKey=CQCPLXCVNXNUCK-HGUWTHONSA-N

SMILES: [Na].O=C(O)C1=C(CSC2=NN=C(S2)C)CSC3N1C(=O)C3NC(=O)CN4N=NN=C4.O

Synonyms:

• 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 3-[[(5-methyl-1,3,4-thiadiazol-2-yl)thio]methyl]-8-oxo-7-[(1H-tetrazol-1-ylacetyl)amino]-, monosodium salt, pentahydrate, (6R-trans)-
• 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 3-[[(5-methyl-1,3,4-thiadiazol-2-yl)thio]methyl]-8-oxo-7-[[2-(1H-tetrazol-1-yl)acetyl]amino]-, sodium salt, hydrate (1:1:5), (6R,7R)-
• 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 3-[[(5-methyl-1,3,4-thiadiazol-2-yl)thio]methyl]-8-oxo-7-[(1H-tetrazol-1-ylacetyl)amino]-, monosodium salt, pentahydrate, (6R,7R)-
• Cefazolin sodium pentahydrate

5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 3-[[(5-methyl-1,3,4-thiadiazol-2-yl)thio]methyl]-8-oxo-7-[[2-(1H-tetrazol-1-yl)acetyl]amino]-, sodium salt, hydrate (1:1:5), (6R,7R)-

CAS: 115850-11-8

• Formula: C₁₄H₁₆N₈NaO₅S₃
• Molecular weight: 495.5122

Cefazolin sodium pentahydrate

CAS: 115850-11-8

Cefazolin sodium pentahydrate: first-gen cephalosporin, treats bacterial infections, has anti-inflammatory properties, may reduce POCD.

• Formula: C₁₄H₂₃N₈NaO₉S₃
• Color and Shape: Liquid
• Molecular weight: 566.57