N-(3-chlorophenyl)-4-[4-(dimethylamino)phenyl]-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-4-[4-(dimethylamino)phenyl]-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
N-(3-chlorophenyl)-4-[4-(dimethylamino)phenyl]-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
Compound characteristics
| Compound ID: | G118-1184 |
| Compound Name: | N-(3-chlorophenyl)-4-[4-(dimethylamino)phenyl]-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide |
| Molecular Weight: | 456.97 |
| Molecular Formula: | C27 H25 Cl N4 O |
| Smiles: | CN(C)c1ccc(cc1)C1c2cccn2c2ccccc2CN1C(Nc1cccc(c1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.604 |
| logD: | 6.5907 |
| logSw: | -6.3852 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 29.3758 |
| InChI Key: | AILHSTPTMRPSHH-AREMUKBSSA-N |