3-{4-[(3-methoxyphenyl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-1-(morpholin-4-yl)propan-1-one
Chemical Structure Depiction of
3-{4-[(3-methoxyphenyl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-1-(morpholin-4-yl)propan-1-one
3-{4-[(3-methoxyphenyl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-1-(morpholin-4-yl)propan-1-one
Compound characteristics
| Compound ID: | S629-2602 |
| Compound Name: | 3-{4-[(3-methoxyphenyl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-1-(morpholin-4-yl)propan-1-one |
| Molecular Weight: | 438.52 |
| Molecular Formula: | C25 H30 N2 O5 |
| Smiles: | COc1cccc(CC(N2CCOc3ccc(CCC(N4CCOCC4)=O)cc3C2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.6358 |
| logD: | 2.6358 |
| logSw: | -2.7292 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.877 |
| InChI Key: | QAAGCGUIDQDXMS-UHFFFAOYSA-N |