3-[4-(cyclopropanecarbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-[3-(piperidin-1-yl)propyl]propanamide
Chemical Structure Depiction of
3-[4-(cyclopropanecarbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-[3-(piperidin-1-yl)propyl]propanamide
3-[4-(cyclopropanecarbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-[3-(piperidin-1-yl)propyl]propanamide
Compound characteristics
| Compound ID: | S629-0336 |
| Compound Name: | 3-[4-(cyclopropanecarbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-[3-(piperidin-1-yl)propyl]propanamide |
| Molecular Weight: | 413.56 |
| Molecular Formula: | C24 H35 N3 O3 |
| Smiles: | C1CCN(CC1)CCCNC(CCc1ccc2c(CN(CCO2)C(C2CC2)=O)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3292 |
| logD: | -0.325 |
| logSw: | -2.9382 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.378 |
| InChI Key: | PBAABVLZAOIJOP-UHFFFAOYSA-N |