Basic information
- Standard SMILES
COC1=CS[C@@H]2[C@H](NC(=O)Cc3ccccc3)C(=O)N2[C@H]1C(=O)OC(c1ccccc1)c1ccccc1- InChIKey
PVKCQKFYJJKIJH-INNMJMHTSA-N- Molecular formula
- C29H26N2O5S
- Average molar mass
- 514.6 g/mol
Names & identifiers
- Preferred name
- 7beta-Phenylacetamido-3-methoxy-ceph-2-em-4alpha-carboxylic acid diphenylmethyl ester
- IUPAC
- benzhydryl (2R,6R,7R)-3-methoxy-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylate
Names & synonyms
SCHEMBL10808858PVKCQKFYJJKIJH-INNMJMHTSA-N7beta-phenylacetamido-3-methoxy-ceph-2-em-4alpha-carboxylic acid diphenylmethyl ester
Database identifiers
- PubChem CID
- 70448481
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 842
Related reactions
3 records
Compound notes
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