2-(methylsulfanyl)-N-(2-phenylethyl)-4-(trifluoromethyl)pyrimidine-5-carboxamide
Chemical Structure Depiction of
2-(methylsulfanyl)-N-(2-phenylethyl)-4-(trifluoromethyl)pyrimidine-5-carboxamide
2-(methylsulfanyl)-N-(2-phenylethyl)-4-(trifluoromethyl)pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | E727-0744 |
| Compound Name: | 2-(methylsulfanyl)-N-(2-phenylethyl)-4-(trifluoromethyl)pyrimidine-5-carboxamide |
| Molecular Weight: | 341.35 |
| Molecular Formula: | C15 H14 F3 N3 O S |
| Smiles: | CSc1ncc(C(NCCc2ccccc2)=O)c(C(F)(F)F)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.0712 |
| logD: | 3.0667 |
| logSw: | -3.4725 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.079 |
| InChI Key: | WRVRNGIGCKYHOS-UHFFFAOYSA-N |