1-{2-[2-(azepan-1-yl)ethyl]piperidin-1-yl}-2-(4-chlorophenyl)ethan-1-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
1-{2-[2-(azepan-1-yl)ethyl]piperidin-1-yl}-2-(4-chlorophenyl)ethan-1-one--hydrogen chloride (1/1)
1-{2-[2-(azepan-1-yl)ethyl]piperidin-1-yl}-2-(4-chlorophenyl)ethan-1-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D185-0642 |
| Compound Name: | 1-{2-[2-(azepan-1-yl)ethyl]piperidin-1-yl}-2-(4-chlorophenyl)ethan-1-one--hydrogen chloride (1/1) |
| Molecular Weight: | 399.4 |
| Molecular Formula: | C21 H31 Cl N2 O |
| Salt: | HCl |
| Smiles: | C1CCCN(CC1)CCC1CCCCN1C(Cc1ccc(cc1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5158 |
| logD: | 2.6973 |
| logSw: | -4.633 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 20.0476 |
| InChI Key: | IWEQQRVVKDUTFQ-HXUWFJFHSA-N |