2-(4-methylphenoxy)-1-{2-[(4-methylpiperidin-1-yl)methyl]azepan-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(4-methylphenoxy)-1-{2-[(4-methylpiperidin-1-yl)methyl]azepan-1-yl}ethan-1-one
2-(4-methylphenoxy)-1-{2-[(4-methylpiperidin-1-yl)methyl]azepan-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | S534-0653 |
| Compound Name: | 2-(4-methylphenoxy)-1-{2-[(4-methylpiperidin-1-yl)methyl]azepan-1-yl}ethan-1-one |
| Molecular Weight: | 358.52 |
| Molecular Formula: | C22 H34 N2 O2 |
| Smiles: | CC1CCN(CC1)CC1CCCCCN1C(COc1ccc(C)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9454 |
| logD: | 2.8486 |
| logSw: | -3.7681 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 27.5683 |
| InChI Key: | IHXBSEWLHCQJET-HXUWFJFHSA-N |