7-[(4-chloro-1-ethyl-1H-pyrazole-3-carbonyl)amino]-3-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Chemical Structure Depiction of
7-[(4-chloro-1-ethyl-1H-pyrazole-3-carbonyl)amino]-3-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Available: 118 mg
Amount:
mg
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Compound characteristics

Compound ID: D052-0100
Compound Name: 7-[(4-chloro-1-ethyl-1H-pyrazole-3-carbonyl)amino]-3-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Molecular Weight: 501
Molecular Formula: C17 H17 Cl N6 O4 S3
Smiles: CCn1cc(c(C(NC2C3N(C(=C(CS3)CSc3nnc(C)s3)C(O)=O)C2=O)=O)n1)[Cl]
Stereo: MIXTURE OF STEREOISOMERS
logP: 0.7508
logD: -4.5109
logSw: -2.445
Hydrogen bond acceptors count: 12
Hydrogen bond donors count: 2
Polar surface area: 107.166
InChI Key: CRWUJGVQONLEQC-UHFFFAOYSA-N
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