1-{7-[(piperidin-1-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}-2-(pyridin-3-yl)ethan-1-one
Chemical Structure Depiction of
1-{7-[(piperidin-1-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}-2-(pyridin-3-yl)ethan-1-one
1-{7-[(piperidin-1-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}-2-(pyridin-3-yl)ethan-1-one
Compound characteristics
| Compound ID: | T634-0677 |
| Compound Name: | 1-{7-[(piperidin-1-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}-2-(pyridin-3-yl)ethan-1-one |
| Molecular Weight: | 365.47 |
| Molecular Formula: | C22 H27 N3 O2 |
| Smiles: | C1CCN(CC1)Cc1ccc2c(CN(CCO2)C(Cc2cccnc2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.4108 |
| logD: | 0.7797 |
| logSw: | -2.3443 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.554 |
| InChI Key: | SGAIHFSGUUXVSM-UHFFFAOYSA-N |