{7-[(azepan-1-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}(6-methoxypyridin-3-yl)methanone
Chemical Structure Depiction of
{7-[(azepan-1-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}(6-methoxypyridin-3-yl)methanone
{7-[(azepan-1-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}(6-methoxypyridin-3-yl)methanone
Compound characteristics
| Compound ID: | T634-0534 |
| Compound Name: | {7-[(azepan-1-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}(6-methoxypyridin-3-yl)methanone |
| Molecular Weight: | 395.5 |
| Molecular Formula: | C23 H29 N3 O3 |
| Smiles: | COc1ccc(cn1)C(N1CCOc2ccc(CN3CCCCCC3)cc2C1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2898 |
| logD: | 1.6838 |
| logSw: | -3.1897 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.476 |
| InChI Key: | BRUKKKFCSRMIBI-UHFFFAOYSA-N |