Basic information
- Standard SMILES
O=c1nc2ccccc2nc2ccccc12- InChIKey
YHGGVHLVYKYOBS-UHFFFAOYSA-N- Molecular formula
- C13H8N2O
- Average molar mass
- 208.21 g/mol
Names & identifiers
- Preferred name
- Benzo[b][1,4]benzodiazepin-6-one
- IUPAC
- benzo[b][1,4]benzodiazepin-6-one
Names & synonyms
YHGGVHLVYKYOBS-UHFFFAOYSA-Nbenzo[b][1,4]benzodiazepin-6-onedibenzo[b,e][1,4]diazepin-11-onedibenzo[b,e][1,4]-diazepine-11-one11H-dibenzo[b,e][1,4]diazepin-11-one
Database identifiers
- PubChem CID
- 19781529
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 41.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 443
Related reactions
2 records
Compound notes
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