N-[(4-methylphenyl)methyl]-4-(thiophen-2-yl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-4-(thiophen-2-yl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
N-[(4-methylphenyl)methyl]-4-(thiophen-2-yl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
Compound characteristics
| Compound ID: | G118-1068 |
| Compound Name: | N-[(4-methylphenyl)methyl]-4-(thiophen-2-yl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide |
| Molecular Weight: | 413.54 |
| Molecular Formula: | C25 H23 N3 O S |
| Smiles: | Cc1ccc(CNC(N2Cc3ccccc3n3cccc3C2c2cccs2)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5706 |
| logD: | 5.5706 |
| logSw: | -5.4347 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 28.9115 |
| InChI Key: | ODGDVHXPFVSCNU-DEOSSOPVSA-N |