Basic information
- Standard SMILES
O=CNC1C(=O)N2C(C(=O)OC(c3ccccc3)c3ccccc3)=C(S/C=C\c3cccnc3)CS[C@H]12- InChIKey
FBSQRPMIHIWZTD-HCPXDVJVSA-N- Molecular formula
- C28H23N3O4S2
- Average molar mass
- 529.6 g/mol
Names & identifiers
- Preferred name
- benzhydryl 7-formamido-3-[(Z)-2-(3-pyridyl)vinylthio]-3-cephem-4-carboxylate
- IUPAC
- benzhydryl (6R)-7-formamido-8-oxo-3-[(Z)-2-pyridin-3-ylethenyl]sulfanyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
Names & synonyms
SCHEMBL10575077FBSQRPMIHIWZTD-HCPXDVJVSA-Nbenzhydryl 7-formamido-3 -[(Z)-2-(3-pyridyl)vinylthio]-3-cephem-4-carboxylate
Database identifiers
- PubChem CID
- 88631981
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 139 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 9
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 880
Related reactions
1 records
Compound notes
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