N-(3,4-dimethoxyphenyl)-4-(propan-2-yl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
Chemical Structure Depiction of
N-(3,4-dimethoxyphenyl)-4-(propan-2-yl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
N-(3,4-dimethoxyphenyl)-4-(propan-2-yl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
Compound characteristics
| Compound ID: | G118-0666 |
| Compound Name: | N-(3,4-dimethoxyphenyl)-4-(propan-2-yl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide |
| Molecular Weight: | 405.5 |
| Molecular Formula: | C24 H27 N3 O3 |
| Smiles: | CC(C)C1c2cccn2c2ccccc2CN1C(Nc1ccc(c(c1)OC)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7741 |
| logD: | 4.7741 |
| logSw: | -4.4235 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.103 |
| InChI Key: | MMQSSNXBJBPFHH-QHCPKHFHSA-N |