N-[(4-fluorophenyl)methyl]-4-methyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-4-methyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
N-[(4-fluorophenyl)methyl]-4-methyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
Compound characteristics
| Compound ID: | G118-0901 |
| Compound Name: | N-[(4-fluorophenyl)methyl]-4-methyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide |
| Molecular Weight: | 349.41 |
| Molecular Formula: | C21 H20 F N3 O |
| Smiles: | CC1c2cccn2c2ccccc2CN1C(NCc1ccc(cc1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0684 |
| logD: | 4.0684 |
| logSw: | -4.054 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.7557 |
| InChI Key: | MVRUBAWJMPMMSO-HNNXBMFYSA-N |