1-(4-{[2-{[(3-methylphenyl)methyl]sulfanyl}-6-(trifluoromethyl)pyrimidin-4-yl]oxy}phenyl)ethan-1-one
Chemical Structure Depiction of
1-(4-{[2-{[(3-methylphenyl)methyl]sulfanyl}-6-(trifluoromethyl)pyrimidin-4-yl]oxy}phenyl)ethan-1-one
1-(4-{[2-{[(3-methylphenyl)methyl]sulfanyl}-6-(trifluoromethyl)pyrimidin-4-yl]oxy}phenyl)ethan-1-one
Compound characteristics
| Compound ID: | V004-0796 |
| Compound Name: | 1-(4-{[2-{[(3-methylphenyl)methyl]sulfanyl}-6-(trifluoromethyl)pyrimidin-4-yl]oxy}phenyl)ethan-1-one |
| Molecular Weight: | 418.44 |
| Molecular Formula: | C21 H17 F3 N2 O2 S |
| Salt: | not_available |
| Smiles: | CC(c1ccc(cc1)Oc1cc(C(F)(F)F)nc(n1)SCc1cccc(C)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7353 |
| logD: | 5.7353 |
| logSw: | -5.4593 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 37.735 |
| InChI Key: | ZXHFGPXJBRMWOE-UHFFFAOYSA-N |