2-(2-methoxyethoxy)-1-{7-[(piperidin-1-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}ethan-1-one
Chemical Structure Depiction of
2-(2-methoxyethoxy)-1-{7-[(piperidin-1-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}ethan-1-one
2-(2-methoxyethoxy)-1-{7-[(piperidin-1-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}ethan-1-one
Compound characteristics
| Compound ID: | T634-0638 |
| Compound Name: | 2-(2-methoxyethoxy)-1-{7-[(piperidin-1-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}ethan-1-one |
| Molecular Weight: | 362.47 |
| Molecular Formula: | C20 H30 N2 O4 |
| Smiles: | COCCOCC(N1CCOc2ccc(CN3CCCCC3)cc2C1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1298 |
| logD: | -0.5012 |
| logSw: | -2.0219 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.003 |
| InChI Key: | WADHATMDBWRNTK-UHFFFAOYSA-N |