N-(3-chlorophenyl)-4-(3,4-dimethoxyphenyl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-4-(3,4-dimethoxyphenyl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
N-(3-chlorophenyl)-4-(3,4-dimethoxyphenyl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
Compound characteristics
| Compound ID: | G118-1491 |
| Compound Name: | N-(3-chlorophenyl)-4-(3,4-dimethoxyphenyl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide |
| Molecular Weight: | 473.96 |
| Molecular Formula: | C27 H24 Cl N3 O3 |
| Smiles: | COc1ccc(cc1OC)C1c2cccn2c2ccccc2CN1C(Nc1cccc(c1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.1766 |
| logD: | 6.1766 |
| logSw: | -6.2675 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.832 |
| InChI Key: | VJVIWBLZGKXDFF-AREMUKBSSA-N |