2-{[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}-N-propylacetamide
Chemical Structure Depiction of
2-{[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}-N-propylacetamide
2-{[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}-N-propylacetamide
Compound characteristics
Compound ID: | 6466-1070 |
Compound Name: | 2-{[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}-N-propylacetamide |
Molecular Weight: | 415.43 |
Molecular Formula: | C18 H20 F3 N3 O3 S |
Smiles: | CCCNC(CSc1nc(cc(C(F)(F)F)n1)c1ccc(c(c1)OC)OC)=O |
Stereo: | ACHIRAL |
logP: | 3.5581 |
logD: | 3.5581 |
logSw: | -3.8547 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 56.834 |
InChI Key: | CGVHCCZOJQELLJ-UHFFFAOYSA-N |