5H-Dibenzo(b,e)(1,4)diazepine, 2-chloro-5-(2-(dimethylamino)ethyl)-11-phenyl-
Basic information
- CAS
32047-66-8- Standard SMILES
CN(C)CCN1c2ccccc2N=C(c2ccccc2)c2cc(Cl)ccc21- InChIKey
SNUOZYUMIBOGNS-UHFFFAOYSA-N- Molecular formula
- C23H22ClN3
- Average molar mass
- 375.9 g/mol
- Monoisotopic mass
- 375.1502254
Names & identifiers
- Preferred name
- 5H-Dibenzo(b,e)(1,4)diazepine, 2-chloro-5-(2-(dimethylamino)ethyl)-11-phenyl-
- IUPAC
- 2-(8-chloro-6-phenylbenzo[b][1,4]benzodiazepin-11-yl)-N,N-dimethylethanamine
- English name
- 2-Chloro-5-[2-(dimethylamino)ethyl]-11-phenyl-5H-dibenzo[b,e][1,4]diazepine
- Molecular formula
- C23H22ClN3
- Molecular weight
- 375.89
Names & synonyms
32047-66-82-Chloro-5-(2-(dimethylamino)ethyl)-11-phenyl-5H-dibenzo(b,e)(1,4)diazepine5H-Dibenzo(b,e)(1,4)diazepine, 2-chloro-5-(2-(dimethylamino)ethyl)-11-phenyl-RefChem:305627SCHEMBL10784894DTXSID30953919DB-2609182-(2-Chloro-11-phenyl-5H-dibenzo[b,e][1,4]diazepin-5-yl)-N,N-dimethylethan-1-amine2-Chloro-5-[2-(dimethylamino)ethyl ]-11-phenyl-5H-dibenzo[b,e][1,4]diazepine2-Chloro-5-[2-(dimethylamino)ethyl]-11-phenyl-5H-dibenzo[b,e][1,4]diazepine5H-Dibenzo[b,e][1,4]diazepine-5-ethanamine, 2-chloro-N,N-dimethyl-11-phenyl-
Database identifiers
- CAS
32047-66-8- PubChem CID
- 208359
- DTXSID
DTXSID30953919- Nikkaji
- J42.188J
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 18.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 514
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Compound notes
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