Basic information
- Standard SMILES
O=C1C[C@H]2SCCCN12- InChIKey
QHTOIDKCEPKVCM-ZCFIWIBFSA-N- Molecular formula
- C6H9NOS
- Average molar mass
- 143.21 g/mol
- Monoisotopic mass
- 143.04048508
Names & identifiers
- Preferred name
- Cepham
- IUPAC
- (6R)-5-thia-1-azabicyclo[4.2.0]octan-8-one
Names & synonyms
cephamCHEBI:35993RefChem:1081338(6R)-5-thia-1-azabicyclo[4.2.0]octan-8-oneSCHEMBL10824175QHTOIDKCEPKVCM-ZCFIWIBFSA-NQ27116660
Database identifiers
- PubChem CID
- 9548841
- ChEBI
CHEBI:35993
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 45.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 148
Related reactions
5 records
Compound notes
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