2-benzyl-N-(propan-2-yl)-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-7-carboxamide
Chemical Structure Depiction of
2-benzyl-N-(propan-2-yl)-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-7-carboxamide
2-benzyl-N-(propan-2-yl)-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-7-carboxamide
Compound characteristics
| Compound ID: | S868-0137 |
| Compound Name: | 2-benzyl-N-(propan-2-yl)-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-7-carboxamide |
| Molecular Weight: | 311.43 |
| Molecular Formula: | C19 H25 N3 O |
| Smiles: | CC(C)NC(c1ccc2CN(CCCn12)Cc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7287 |
| logD: | 2.6824 |
| logSw: | -3.0306 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 28.4491 |
| InChI Key: | ASGRMFNFBQOASK-UHFFFAOYSA-N |