3-(4-acetyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-N-(1-methylpiperidin-4-yl)propanamide
Chemical Structure Depiction of
3-(4-acetyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-N-(1-methylpiperidin-4-yl)propanamide
3-(4-acetyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-N-(1-methylpiperidin-4-yl)propanamide
Compound characteristics
| Compound ID: | S629-0097 |
| Compound Name: | 3-(4-acetyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-N-(1-methylpiperidin-4-yl)propanamide |
| Molecular Weight: | 359.47 |
| Molecular Formula: | C20 H29 N3 O3 |
| Smiles: | CC(N1CCOc2ccc(CCC(NC3CCN(C)CC3)=O)cc2C1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9209 |
| logD: | -1.6133 |
| logSw: | -2.1604 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.972 |
| InChI Key: | NJIZQEVLINOFHN-UHFFFAOYSA-N |