2-(methylsulfanyl)-4-phenyl-N-[3-(trifluoromethyl)phenyl]pyrimidine-5-carboxamide
Chemical Structure Depiction of
2-(methylsulfanyl)-4-phenyl-N-[3-(trifluoromethyl)phenyl]pyrimidine-5-carboxamide
2-(methylsulfanyl)-4-phenyl-N-[3-(trifluoromethyl)phenyl]pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | E727-0338 |
| Compound Name: | 2-(methylsulfanyl)-4-phenyl-N-[3-(trifluoromethyl)phenyl]pyrimidine-5-carboxamide |
| Molecular Weight: | 389.4 |
| Molecular Formula: | C19 H14 F3 N3 O S |
| Smiles: | CSc1ncc(C(Nc2cccc(c2)C(F)(F)F)=O)c(c2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.9418 |
| logD: | 4.9358 |
| logSw: | -4.5392 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.643 |
| InChI Key: | XLRGJGXFYAZBRD-UHFFFAOYSA-N |