6-(2-Phenoxyacetamido)-2,2-dimethylpenam-3-carboxylic acid
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Basic information
- Standard SMILES
CC1(C)S[C@@H]2C(NC(=O)COc3ccccc3)C(=O)N2C1C(=O)O- InChIKey
BPLBGHOLXOTWMN-ORHYLEIMSA-N- Molecular formula
- C16H18N2O5S
- Average molar mass
- 350.4 g/mol
Names & identifiers
- Preferred name
- 6-(2-Phenoxyacetamido)-2,2-dimethylpenam-3-carboxylic acid
- IUPAC
- (5R)-3,3-dimethyl-7-oxo-6-[(2-phenoxyacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
Names & synonyms
SCHEMBL10411086BPLBGHOLXOTWMN-ORHYLEIMSA-N6-phenoxyacetamido-2,2-dimethylpenam-3-carboxylic acid6-(2-phenoxvacetamido)-2,2-dimethylpenam-3-carboxylic acid6-(2-phenoxyacetamido)-2,2-dimethylpenam-3-carboxylic acid
Database identifiers
- PubChem CID
- 12373893
Properties
Computed structural propertiesFilling in
- XLogP
- 2.1
- Topological polar surface area
- 121 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 547
Related reactions
23 records
Compound notes
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