4-[(2H-1,3-benzodioxol-5-yl)oxy]-2-{[(2,6-difluorophenyl)methyl]sulfanyl}-6-(trifluoromethyl)pyrimidine
Chemical Structure Depiction of
4-[(2H-1,3-benzodioxol-5-yl)oxy]-2-{[(2,6-difluorophenyl)methyl]sulfanyl}-6-(trifluoromethyl)pyrimidine
4-[(2H-1,3-benzodioxol-5-yl)oxy]-2-{[(2,6-difluorophenyl)methyl]sulfanyl}-6-(trifluoromethyl)pyrimidine
Compound characteristics
| Compound ID: | V004-0737 |
| Compound Name: | 4-[(2H-1,3-benzodioxol-5-yl)oxy]-2-{[(2,6-difluorophenyl)methyl]sulfanyl}-6-(trifluoromethyl)pyrimidine |
| Molecular Weight: | 442.36 |
| Molecular Formula: | C19 H11 F5 N2 O3 S |
| Salt: | not_available |
| Smiles: | C1Oc2ccc(cc2O1)Oc1cc(C(F)(F)F)nc(n1)SCc1c(cccc1F)F |
| Stereo: | ACHIRAL |
| logP: | 5.4122 |
| logD: | 5.4122 |
| logSw: | -5.9477 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.024 |
| InChI Key: | PWMAKDZKSRLWLI-UHFFFAOYSA-N |