2,3-Dimethyl-N11-ethyl-5,11-dihydro-6H-dipyrido(3,2-b:2',3'-e)(1,4)diazepin-6-one
Basic information
- CAS
133627-26-6- Standard SMILES
CCN1c2nc(C)c(C)cc2NC(=O)c2cccnc21- InChIKey
UDYVQHNUUVSPGO-UHFFFAOYSA-N- Molecular formula
- C15H16N4O
- Average molar mass
- 268.31 g/mol
- Monoisotopic mass
- 268.13241115
Names & identifiers
- Preferred name
- 2,3-Dimethyl-N11-ethyl-5,11-dihydro-6H-dipyrido(3,2-b:2',3'-e)(1,4)diazepin-6-one
- IUPAC
- 2-ethyl-5,6-dimethyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one
Names & synonyms
133627-26-62,3-Dimethyl-N11-ethyl-5,11-dihydro-6H-dipyrido(3,2-b:2',3'-e)(1,4)diazepin-6-one2,3-Dimethyl-N11-ethyl-5,11-dihydro-6H-dipyrido[3,2-b:2',3'-e][1,4]diazepin-6-oneDipyridodiazepinone deriv. 104BDBM1668CHEMBL311349DTXSID1015826311-ethyl-2,3-dimethyl-5H-dipyrido[[?],[?]][1,4]diazepin-6-one11-Ethyl-2,3-dimethyl-5,11-dihydro-6H-dipyrido[3,2-b:2',3'-e][1,4]diazepin-6-one2-ethyl-5,6-dimethyl-2,4,9,15-tetraazatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one
Database identifiers
- CAS
133627-26-6- PubChem CID
- 453340
- DTXSID
DTXSID10158263- ChEMBL
CHEMBL311349- Nikkaji
- J420.609F
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 58.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 375
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Compound notes
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