3-(4-acetyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-N-(3-methoxyphenyl)propanamide
Chemical Structure Depiction of
3-(4-acetyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-N-(3-methoxyphenyl)propanamide
3-(4-acetyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-N-(3-methoxyphenyl)propanamide
Compound characteristics
| Compound ID: | S629-0043 |
| Compound Name: | 3-(4-acetyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-N-(3-methoxyphenyl)propanamide |
| Molecular Weight: | 368.43 |
| Molecular Formula: | C21 H24 N2 O4 |
| Smiles: | CC(N1CCOc2ccc(CCC(Nc3cccc(c3)OC)=O)cc2C1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8438 |
| logD: | 2.8437 |
| logSw: | -3.3122 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.992 |
| InChI Key: | KDOBNIKHOKMKDX-UHFFFAOYSA-N |