8,N5-Dimethyl-N11-ethyl-5,11-dihydro-6H-pyrido(2,3-b)(1,4)benzodiazepin-6-one
Basic information
- CAS
132932-27-5- Standard SMILES
CCN1c2ccc(C)cc2C(=O)N(C)c2cccnc21- InChIKey
FVWGHCOXOCWOOO-UHFFFAOYSA-N- Molecular formula
- C16H17N3O
- Average molar mass
- 267.33 g/mol
- Monoisotopic mass
- 267.13716217
Names & identifiers
- Preferred name
- 8,N5-Dimethyl-N11-ethyl-5,11-dihydro-6H-pyrido(2,3-b)(1,4)benzodiazepin-6-one
- IUPAC
- 11-ethyl-5,8-dimethylpyrido[2,3-b][1,4]benzodiazepin-6-one
Names & synonyms
132932-27-58,N5-Dimethyl-N11-ethyl-5,11-dihydro-6H-pyrido(2,3-b)(1,4)benzodiazepin-6-one8,N5-Dimethyl-N11-ethyl-5,11-dihydro-6H-pyrido[2,3-b][1,4]benzodiazepin-6-oneBDBM1673CHEMBL312340SCHEMBL9369457DTXSID40157865Pyridobenzodiazepinone deriv. 11811-ethyl-5,8-dimethyl-pyrido[2,3-b][1,4]benzodiazepin-6-one11-Ethyl-5,8-dimethyl-5,11-dihydro-6H-pyrido[2,3-b][1,4]benzodiazepin-6-one2-ethyl-9,13-dimethyl-2,4,9-triazatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one
Database identifiers
- CAS
132932-27-5- PubChem CID
- 453353
- DTXSID
DTXSID40157865- ChEMBL
CHEMBL312340- Nikkaji
- J420.621E
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 36.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 373
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Compound notes
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