4-(3,5-difluorophenyl)-N-[(3-methoxyphenyl)methyl]-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
Chemical Structure Depiction of
4-(3,5-difluorophenyl)-N-[(3-methoxyphenyl)methyl]-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
4-(3,5-difluorophenyl)-N-[(3-methoxyphenyl)methyl]-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
Compound characteristics
| Compound ID: | G118-1393 |
| Compound Name: | 4-(3,5-difluorophenyl)-N-[(3-methoxyphenyl)methyl]-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide |
| Molecular Weight: | 459.5 |
| Molecular Formula: | C27 H23 F2 N3 O2 |
| Smiles: | COc1cccc(CNC(N2Cc3ccccc3n3cccc3C2c2cc(cc(c2)F)F)=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8458 |
| logD: | 5.8458 |
| logSw: | -5.5307 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.437 |
| InChI Key: | JSRQAJWXVAQXJE-AREMUKBSSA-N |