Basic information
- CAS
32038-67-8- Standard SMILES
C[NH+](C)CCCN1c2ccccc2NC(=O)c2ccc(Cl)cc21.[Cl-]- InChIKey
GGLQKLQQWQDYAR-UHFFFAOYSA-N- Molecular formula
- C18H21Cl2N3O
- Average molar mass
- 366.3 g/mol
- Monoisotopic mass
- 365.1061677
Names & identifiers
- Preferred name
- 11H-Dibenzo(b,e)(1,4)diazepin-11-one, 5,10-dihydro-3-chloro-5-(3-(dimethylamino)propyl)-, hydrochloride
- IUPAC
- 3-(9-chloro-6-oxo-5H-benzo[b][1,4]benzodiazepin-11-yl)propyl-dimethylazanium chloride
Names & synonyms
32038-67-811H-Dibenzo(b,e)(1,4)diazepin-11-one, 5,10-dihydro-3-chloro-5-(3-(dimethylamino)propyl)-, hydrochlorideRefChem:236260
Database identifiers
- CAS
32038-67-8- PubChem CID
- 36033
Properties
Computed structural properties
- Topological polar surface area
- 36.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 417
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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