N-(3-bromophenyl)-4-ethyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
Chemical Structure Depiction of
N-(3-bromophenyl)-4-ethyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
N-(3-bromophenyl)-4-ethyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
Compound characteristics
| Compound ID: | G118-0771 |
| Compound Name: | N-(3-bromophenyl)-4-ethyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide |
| Molecular Weight: | 410.31 |
| Molecular Formula: | C21 H20 Br N3 O |
| Smiles: | CCC1c2cccn2c2ccccc2CN1C(Nc1cccc(c1)[Br])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7197 |
| logD: | 5.7197 |
| logSw: | -5.3897 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 26.7949 |
| InChI Key: | XPIISHGAKKSWGV-SFHVURJKSA-N |