Basic information
- Standard SMILES
O=C1C[C@H]2SCCN12- InChIKey
WSHJJCPTKWSMRR-RXMQYKEDSA-N- Molecular formula
- C5H7NOS
- Average molar mass
- 129.18 g/mol
- Monoisotopic mass
- 129.02483502
Names & identifiers
- Preferred name
- Penam
- IUPAC
- (5R)-4-thia-1-azabicyclo[3.2.0]heptan-7-one
Names & synonyms
Penamclavams(5R)-4-thia-1-azabicyclo[3.2.0]heptan-7-oneCHEBI:35991(5R)-4-thia-1-azabicyclo(3.2.0)heptan-7-oneRefChem:170735ClavamSCHEMBL122892WSHJJCPTKWSMRR-RXMQYKEDSA-NQ2413616
Database identifiers
- PubChem CID
- 9548842
- ChEBI
CHEBI:35991- Nikkaji
- J1.220.926F
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 45.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 136
Related reactions
6 records
Compound notes
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