2-(4-methylphenoxy)-1-{7-[(morpholin-4-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}ethan-1-one
Chemical Structure Depiction of
2-(4-methylphenoxy)-1-{7-[(morpholin-4-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}ethan-1-one
2-(4-methylphenoxy)-1-{7-[(morpholin-4-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}ethan-1-one
Compound characteristics
| Compound ID: | T634-0121 |
| Compound Name: | 2-(4-methylphenoxy)-1-{7-[(morpholin-4-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}ethan-1-one |
| Molecular Weight: | 396.49 |
| Molecular Formula: | C23 H28 N2 O4 |
| Smiles: | Cc1ccc(cc1)OCC(N1CCOc2ccc(CN3CCOCC3)cc2C1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5165 |
| logD: | 2.4546 |
| logSw: | -2.6461 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.444 |
| InChI Key: | WWCIERKNEKLSNC-UHFFFAOYSA-N |