4-[4-(dimethylamino)phenyl]-N-[(4-fluorophenyl)methyl]-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
Chemical Structure Depiction of
4-[4-(dimethylamino)phenyl]-N-[(4-fluorophenyl)methyl]-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
4-[4-(dimethylamino)phenyl]-N-[(4-fluorophenyl)methyl]-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
Compound characteristics
| Compound ID: | G118-1240 |
| Compound Name: | 4-[4-(dimethylamino)phenyl]-N-[(4-fluorophenyl)methyl]-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide |
| Molecular Weight: | 454.55 |
| Molecular Formula: | C28 H27 F N4 O |
| Smiles: | CN(C)c1ccc(cc1)C1c2cccn2c2ccccc2CN1C(NCc1ccc(cc1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6421 |
| logD: | 5.6288 |
| logSw: | -5.4937 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 30.6979 |
| InChI Key: | MBVLSDFPEHSBGD-HHHXNRCGSA-N |