11H-Dibenzo(b,e)(1,4)diazepin-11-one, 5,10-dihydro-10-(3-(dimethylamino)propyl)-
Basic information
- CAS
4231-96-3- Standard SMILES
CN(C)CCCN1C(=O)c2ccccc2Nc2ccccc21- InChIKey
TXFLRWLXYPVPIQ-UHFFFAOYSA-N- Molecular formula
- C18H21N3O
- Average molar mass
- 295.4 g/mol
- Monoisotopic mass
- 295.1684623
Names & identifiers
- Preferred name
- 11H-Dibenzo(b,e)(1,4)diazepin-11-one, 5,10-dihydro-10-(3-(dimethylamino)propyl)-
- IUPAC
- 5-[3-(dimethylamino)propyl]-11H-benzo[b][1,4]benzodiazepin-6-one
Names & synonyms
11H-DIBENZO(b,e)(1,4)DIAZEPIN-11-ONE, 5,10-DIHYDRO-10-(3-(DIMETHYLAMINO)PROPYL)-4231-96-3DTXSID30195130RefChem:1057391DTXCID4011762110-(3-(Dimethylamino)propyl)-5,10-dihydro-11H-dibenzo(b,e)(1,4)diazepin-11-one10-[3-(dimethylamino)propyl]-5,10-dihydro-11H-dibenzo[b,e][1,4]diazepin-11-oneBRN 0686679
Database identifiers
- CAS
4231-96-3- PubChem CID
- 20220
- DTXSID
DTXSID30195130- Nikkaji
- J42.201K
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 35.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 385
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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