4-ethyl-2-(methylsulfanyl)-N-[3-(trifluoromethyl)phenyl]pyrimidine-5-carboxamide
Chemical Structure Depiction of
4-ethyl-2-(methylsulfanyl)-N-[3-(trifluoromethyl)phenyl]pyrimidine-5-carboxamide
4-ethyl-2-(methylsulfanyl)-N-[3-(trifluoromethyl)phenyl]pyrimidine-5-carboxamide
Compound characteristics
Compound ID: | E727-0990 |
Compound Name: | 4-ethyl-2-(methylsulfanyl)-N-[3-(trifluoromethyl)phenyl]pyrimidine-5-carboxamide |
Molecular Weight: | 341.35 |
Molecular Formula: | C15 H14 F3 N3 O S |
Smiles: | CCc1c(cnc(n1)SC)C(Nc1cccc(c1)C(F)(F)F)=O |
Stereo: | ACHIRAL |
logP: | 4.0948 |
logD: | 3.9261 |
logSw: | -4.114 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 42.41 |
InChI Key: | BVASACGHWKHBKG-UHFFFAOYSA-N |