1-{2-[2-(azepan-1-yl)ethyl]piperidin-1-yl}-2-(4-methoxyphenyl)ethan-1-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
1-{2-[2-(azepan-1-yl)ethyl]piperidin-1-yl}-2-(4-methoxyphenyl)ethan-1-one--hydrogen chloride (1/1)
1-{2-[2-(azepan-1-yl)ethyl]piperidin-1-yl}-2-(4-methoxyphenyl)ethan-1-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D185-0643 |
| Compound Name: | 1-{2-[2-(azepan-1-yl)ethyl]piperidin-1-yl}-2-(4-methoxyphenyl)ethan-1-one--hydrogen chloride (1/1) |
| Molecular Weight: | 394.98 |
| Molecular Formula: | C22 H34 N2 O2 |
| Salt: | HCl |
| Smiles: | COc1ccc(CC(N2CCCCC2CCN2CCCCCC2)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9034 |
| logD: | 2.085 |
| logSw: | -3.93 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 27.5913 |
| InChI Key: | PDCRVGCUNMFCMT-HXUWFJFHSA-N |