N-(4-bromo-3-methylphenyl)-4-ethyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
Chemical Structure Depiction of
N-(4-bromo-3-methylphenyl)-4-ethyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
N-(4-bromo-3-methylphenyl)-4-ethyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
Compound characteristics
| Compound ID: | G118-0791 |
| Compound Name: | N-(4-bromo-3-methylphenyl)-4-ethyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide |
| Molecular Weight: | 424.34 |
| Molecular Formula: | C22 H22 Br N3 O |
| Smiles: | CCC1c2cccn2c2ccccc2CN1C(Nc1ccc(c(C)c1)[Br])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.0862 |
| logD: | 6.0862 |
| logSw: | -5.4035 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 26.7949 |
| InChI Key: | AJCYZANIUKSHMK-IBGZPJMESA-N |