N-(3-methoxypropyl)-4-[4-(propan-2-yl)phenyl]-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
Chemical Structure Depiction of
N-(3-methoxypropyl)-4-[4-(propan-2-yl)phenyl]-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
N-(3-methoxypropyl)-4-[4-(propan-2-yl)phenyl]-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
Compound characteristics
| Compound ID: | G118-0624 |
| Compound Name: | N-(3-methoxypropyl)-4-[4-(propan-2-yl)phenyl]-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide |
| Molecular Weight: | 417.55 |
| Molecular Formula: | C26 H31 N3 O2 |
| Smiles: | CC(C)c1ccc(cc1)C1c2cccn2c2ccccc2CN1C(NCCCOC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.0365 |
| logD: | 6.0365 |
| logSw: | -5.4651 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.349 |
| InChI Key: | AZAFBDSQXGPXEL-RUZDIDTESA-N |