2-(2-chlorophenoxy)-1-{4-[(pyridin-4-yl)methyl]piperazin-1-yl}ethan-1-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
2-(2-chlorophenoxy)-1-{4-[(pyridin-4-yl)methyl]piperazin-1-yl}ethan-1-one--hydrogen chloride (1/1)
2-(2-chlorophenoxy)-1-{4-[(pyridin-4-yl)methyl]piperazin-1-yl}ethan-1-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D653-0031 |
| Compound Name: | 2-(2-chlorophenoxy)-1-{4-[(pyridin-4-yl)methyl]piperazin-1-yl}ethan-1-one--hydrogen chloride (1/1) |
| Molecular Weight: | 382.29 |
| Molecular Formula: | C18 H20 Cl N3 O2 |
| Salt: | HCl |
| Smiles: | C1CN(CCN1Cc1ccncc1)C(COc1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 1.2375 |
| logD: | 1.2131 |
| logSw: | -2.1996 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.914 |
| InChI Key: | TZAJJRMDFDTNQR-UHFFFAOYSA-N |