3-(4-acetyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-N-{2-[1-(propan-2-yl)piperidin-4-yl]ethyl}propanamide
Chemical Structure Depiction of
3-(4-acetyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-N-{2-[1-(propan-2-yl)piperidin-4-yl]ethyl}propanamide
3-(4-acetyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-N-{2-[1-(propan-2-yl)piperidin-4-yl]ethyl}propanamide
Compound characteristics
| Compound ID: | S629-0160 |
| Compound Name: | 3-(4-acetyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-N-{2-[1-(propan-2-yl)piperidin-4-yl]ethyl}propanamide |
| Molecular Weight: | 415.58 |
| Molecular Formula: | C24 H37 N3 O3 |
| Smiles: | CC(C)N1CCC(CCNC(CCc2ccc3c(CN(CCO3)C(C)=O)c2)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 2.4169 |
| logD: | -0.0036 |
| logSw: | -2.89 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.668 |
| InChI Key: | OCMLJJWFAUQNSP-UHFFFAOYSA-N |