2-methoxy-1-{7-[(piperidin-1-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}ethan-1-one
Chemical Structure Depiction of
2-methoxy-1-{7-[(piperidin-1-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}ethan-1-one
2-methoxy-1-{7-[(piperidin-1-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}ethan-1-one
Compound characteristics
| Compound ID: | T634-0635 |
| Compound Name: | 2-methoxy-1-{7-[(piperidin-1-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}ethan-1-one |
| Molecular Weight: | 318.41 |
| Molecular Formula: | C18 H26 N2 O3 |
| Smiles: | COCC(N1CCOc2ccc(CN3CCCCC3)cc2C1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5842 |
| logD: | -0.0468 |
| logSw: | -2.0253 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.731 |
| InChI Key: | UUBOWUBLFKWNFO-UHFFFAOYSA-N |