(r)-5,11-Dihydro-5-[1-[(4-dimethylaminophenyl)ethyl]pyrrolidine-3-yl]dibenzo[b,e][1,4] oxazepine dihydrochloride
Basic information
- Standard SMILES
CN(C)c1ccc(CCN2CC[C@@H](N3c4ccccc4COc4ccccc43)C2)cc1.Cl.Cl- InChIKey
ADYVBABCAVBBDU-PPLJNSMQSA-N- Molecular formula
- C27H33Cl2N3O
- Average molar mass
- 486.5 g/mol
Names & identifiers
- Preferred name
- (r)-5,11-Dihydro-5-[1-[(4-dimethylaminophenyl)ethyl]pyrrolidine-3-yl]dibenzo[b,e][1,4] oxazepine dihydrochloride
- IUPAC
- 4-[2-[(3R)-3-(6H-benzo[c][1,5]benzoxazepin-11-yl)pyrrolidin-1-yl]ethyl]-N,N-dimethylaniline;dihydrochloride
Names & synonyms
SCHEMBL6803821ADYVBABCAVBBDU-PPLJNSMQSA-N(r)-5,11-dihydro-5-[1-[(4-dimethylaminophenyl)ethyl]pyrrolidine-3-yl]dibenzo[b,e][1,4] oxazepine dihydrochloride(r)-5,11-dihydro-5-[1-[(4-dimethylaminophenyl)ethyl]pyrrolidine-3-yl]dibenzo[b,e][1,4]oxazepine dihydrochloride
Database identifiers
- PubChem CID
- 69901100
Properties
Computed structural properties
- Topological polar surface area
- 19 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 561
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
1 records
Compound notes
Loading…