N-(3-chloro-4-fluorophenyl)-4-(4-ethylphenyl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-4-(4-ethylphenyl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
N-(3-chloro-4-fluorophenyl)-4-(4-ethylphenyl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
Compound characteristics
| Compound ID: | G118-1745 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-4-(4-ethylphenyl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide |
| Molecular Weight: | 459.95 |
| Molecular Formula: | C27 H23 Cl F N3 O |
| Smiles: | CCc1ccc(cc1)C1c2cccn2c2ccccc2CN1C(Nc1ccc(c(c1)[Cl])F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.4213 |
| logD: | 7.4212 |
| logSw: | -6.4838 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 26.571 |
| InChI Key: | DAIQZNIJZYQMGX-AREMUKBSSA-N |