2-{[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}-1-(2-ethylpiperidin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-{[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}-1-(2-ethylpiperidin-1-yl)ethan-1-one
2-{[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}-1-(2-ethylpiperidin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | 7213-0365 |
| Compound Name: | 2-{[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}-1-(2-ethylpiperidin-1-yl)ethan-1-one |
| Molecular Weight: | 469.53 |
| Molecular Formula: | C22 H26 F3 N3 O3 S |
| Smiles: | CCC1CCCCN1C(CSc1nc(cc(C(F)(F)F)n1)c1ccc(c(c1)OC)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8039 |
| logD: | 4.8039 |
| logSw: | -4.7089 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.288 |
| InChI Key: | WXEQXKIVKNSZRD-HNNXBMFYSA-N |