1-[8-Fluoro-5-(4-fluorophenyl)-2,3,4,5-tetrahydro-1-benzazepin-1-yl]-2-pyrrolidin-1-ylethanone
Basic information
- CAS
77795-95-0- Standard SMILES
O=C(CN1CCCC1)N1CCCC(c2ccc(F)cc2)c2ccc(F)cc21- InChIKey
GYMSCQAXVNEANR-UHFFFAOYSA-N- Molecular formula
- C22H24F2N2O
- Average molar mass
- 370.4 g/mol
Names & identifiers
- Preferred name
- 1-[8-Fluoro-5-(4-fluorophenyl)-2,3,4,5-tetrahydro-1-benzazepin-1-yl]-2-pyrrolidin-1-ylethanone
- IUPAC
- 1-[8-fluoro-5-(4-fluorophenyl)-2,3,4,5-tetrahydro-1-benzazepin-1-yl]-2-pyrrolidin-1-ylethanone
- English name
- 8-Fluoro-5-(4-fluorophenyl)-1-(pyrrolizinoacetyl)-2,3,4,5-tetrahydro-1H-1-benzazepine
- Molecular formula
- C22H24F2N2O
- Molecular weight
- 370.44
Names & synonyms
77795-95-08-Fluoro-5-(4-fluorophenyl)-1-(pyrrolizinoacetyl)-2,3,4,5-tetrahydro-1H-1-benzazepine8-fluoro-5-(4-fluorophenyl)-1-(1-pyrrolidinylacetyl)-2,3,4,5-tetrahydro-1H-1-benzazepine1-[8-fluoro-5-(4-fluorophenyl)-2,3,4,5-tetrahydro-1-benzazepin-1-yl]-2-pyrrolidin-1-ylethanoneAE-641/00192016CHEMBL1624056NCGC00247084-018-Fluoro-5-(4-fluorophenyl)-2,3,4,5-tetrahydro-1-(1-pyrrolidinylacetyl)-1H-1-benzazepineEthanone, 1-[8-fluoro-5-(4-fluorophenyl)-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl]-2-(1-pyrrolidinyl)-
Database identifiers
- CAS
77795-95-0- ChEMBL
CHEMBL1624056- Nikkaji
- J384.027A
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 23.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 503
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…