N-(3-chloro-4-methylphenyl)-4-phenyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-4-phenyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
N-(3-chloro-4-methylphenyl)-4-phenyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
Compound characteristics
| Compound ID: | G118-0927 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-4-phenyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide |
| Molecular Weight: | 427.93 |
| Molecular Formula: | C26 H22 Cl N3 O |
| Smiles: | Cc1ccc(cc1[Cl])NC(N1Cc2ccccc2n2cccc2C1c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.1549 |
| logD: | 7.1549 |
| logSw: | -6.3076 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 26.571 |
| InChI Key: | VPUWVMWJSMXLGX-RUZDIDTESA-N |