6H-Dibenz(b,e)azepin-6-one, 5,11-dihydro-11-(diisopropylamino)-
Basic information
- CAS
25598-14-5- Standard SMILES
CC(C)N(C(C)C)C1c2ccccc2NC(=O)c2ccccc21- InChIKey
QOIHVZOIVVVXGF-UHFFFAOYSA-N- Molecular formula
- C20H24N2O
- Average molar mass
- 308.4 g/mol
- Monoisotopic mass
- 308.18886339
Names & identifiers
- Preferred name
- 6H-Dibenz(b,e)azepin-6-one, 5,11-dihydro-11-(diisopropylamino)-
- IUPAC
- 11-[di(propan-2-yl)amino]-5,11-dihydrobenzo[c][1]benzazepin-6-one
Names & synonyms
25598-14-5BRN 042294711-(Diisopropylamino)-6(5H)-morphanthridinone6H-Dibenz(b,e)azepin-6-one, 5,11-dihydro-11-(diisopropylamino)-6(5H)-Morphanthridinone, 11-(diisopropylamino)-DTXSID3094846611-[Di(propan-2-yl)amino]-11H-dibenzo[b,e]azepin-6-ol
Database identifiers
- CAS
25598-14-5- PubChem CID
- 213147
- DTXSID
DTXSID30948466
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 412
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Compound notes
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