3-({[4-(3-chlorophenoxy)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)benzonitrile
Chemical Structure Depiction of
3-({[4-(3-chlorophenoxy)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)benzonitrile
3-({[4-(3-chlorophenoxy)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)benzonitrile
Compound characteristics
| Compound ID: | V022-5915 |
| Compound Name: | 3-({[4-(3-chlorophenoxy)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)benzonitrile |
| Molecular Weight: | 421.83 |
| Molecular Formula: | C19 H11 Cl F3 N3 O S |
| Salt: | not_available |
| Smiles: | C(c1cccc(C#N)c1)Sc1nc(cc(n1)Oc1cccc(c1)[Cl])C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 5.8311 |
| logD: | 5.8311 |
| logSw: | -6.2883 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.965 |
| InChI Key: | ULCOIAZICLJUMH-UHFFFAOYSA-N |