N-(3-chloro-4-fluorophenyl)-4-methyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-4-methyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
N-(3-chloro-4-fluorophenyl)-4-methyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
Compound characteristics
| Compound ID: | G118-0851 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-4-methyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide |
| Molecular Weight: | 369.82 |
| Molecular Formula: | C20 H17 Cl F N3 O |
| Smiles: | CC1c2cccn2c2ccccc2CN1C(Nc1ccc(c(c1)[Cl])F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.007 |
| logD: | 5.0068 |
| logSw: | -5.1132 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 26.4336 |
| InChI Key: | XGQJFFJIJPXYCK-ZDUSSCGKSA-N |