{4-[2-(pyridin-2-yl)ethyl]piperazin-1-yl}(3,4,5-trimethoxyphenyl)methanone--hydrogen chloride (1/1)
Chemical Structure Depiction of
{4-[2-(pyridin-2-yl)ethyl]piperazin-1-yl}(3,4,5-trimethoxyphenyl)methanone--hydrogen chloride (1/1)
{4-[2-(pyridin-2-yl)ethyl]piperazin-1-yl}(3,4,5-trimethoxyphenyl)methanone--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D345-0030 |
| Compound Name: | {4-[2-(pyridin-2-yl)ethyl]piperazin-1-yl}(3,4,5-trimethoxyphenyl)methanone--hydrogen chloride (1/1) |
| Molecular Weight: | 421.92 |
| Molecular Formula: | C21 H27 N3 O4 |
| Salt: | HCl |
| Smiles: | COc1cc(cc(c1OC)OC)C(N1CCN(CCc2ccccn2)CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3752 |
| logD: | 1.3548 |
| logSw: | -1.9715 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.927 |
| InChI Key: | YUKWCLRWZOPINM-UHFFFAOYSA-N |