2-(3-chlorophenoxy)-1-{4-[2-(pyridin-4-yl)ethyl]piperazin-1-yl}ethan-1-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
2-(3-chlorophenoxy)-1-{4-[2-(pyridin-4-yl)ethyl]piperazin-1-yl}ethan-1-one--hydrogen chloride (1/1)
2-(3-chlorophenoxy)-1-{4-[2-(pyridin-4-yl)ethyl]piperazin-1-yl}ethan-1-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D339-0581 |
| Compound Name: | 2-(3-chlorophenoxy)-1-{4-[2-(pyridin-4-yl)ethyl]piperazin-1-yl}ethan-1-one--hydrogen chloride (1/1) |
| Molecular Weight: | 396.32 |
| Molecular Formula: | C19 H22 Cl N3 O2 |
| Salt: | HCl |
| Smiles: | C(CN1CCN(CC1)C(COc1cccc(c1)[Cl])=O)c1ccncc1 |
| Stereo: | ACHIRAL |
| logP: | 1.8953 |
| logD: | 1.8419 |
| logSw: | -2.5602 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.806 |
| InChI Key: | JPFSRDHYNUHDJJ-UHFFFAOYSA-N |