4-(4-ethoxyphenyl)-N-(4-fluorophenyl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
Chemical Structure Depiction of
4-(4-ethoxyphenyl)-N-(4-fluorophenyl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
4-(4-ethoxyphenyl)-N-(4-fluorophenyl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
Compound characteristics
| Compound ID: | G118-0464 |
| Compound Name: | 4-(4-ethoxyphenyl)-N-(4-fluorophenyl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide |
| Molecular Weight: | 441.5 |
| Molecular Formula: | C27 H24 F N3 O2 |
| Smiles: | CCOc1ccc(cc1)C1c2cccn2c2ccccc2CN1C(Nc1ccc(cc1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.1585 |
| logD: | 6.1585 |
| logSw: | -5.5771 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 33.695 |
| InChI Key: | XRQDTFINXDWTDS-AREMUKBSSA-N |