2-(2,3-dimethylphenoxy)-1-{4-[2-(pyridin-4-yl)ethyl]piperazin-1-yl}ethan-1-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
2-(2,3-dimethylphenoxy)-1-{4-[2-(pyridin-4-yl)ethyl]piperazin-1-yl}ethan-1-one--hydrogen chloride (1/1)
2-(2,3-dimethylphenoxy)-1-{4-[2-(pyridin-4-yl)ethyl]piperazin-1-yl}ethan-1-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D339-0551 |
| Compound Name: | 2-(2,3-dimethylphenoxy)-1-{4-[2-(pyridin-4-yl)ethyl]piperazin-1-yl}ethan-1-one--hydrogen chloride (1/1) |
| Molecular Weight: | 389.92 |
| Molecular Formula: | C21 H27 N3 O2 |
| Salt: | HCl |
| Smiles: | Cc1cccc(c1C)OCC(N1CCN(CCc2ccncc2)CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9772 |
| logD: | 1.9239 |
| logSw: | -1.6697 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.892 |
| InChI Key: | YZNJIBBOEQMMGK-UHFFFAOYSA-N |