N-[(4-methylphenyl)methyl]-2-(methylsulfanyl)-4-(trifluoromethyl)pyrimidine-5-carboxamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-2-(methylsulfanyl)-4-(trifluoromethyl)pyrimidine-5-carboxamide
N-[(4-methylphenyl)methyl]-2-(methylsulfanyl)-4-(trifluoromethyl)pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | E727-0718 |
| Compound Name: | N-[(4-methylphenyl)methyl]-2-(methylsulfanyl)-4-(trifluoromethyl)pyrimidine-5-carboxamide |
| Molecular Weight: | 341.35 |
| Molecular Formula: | C15 H14 F3 N3 O S |
| Smiles: | Cc1ccc(CNC(c2cnc(nc2C(F)(F)F)SC)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.561 |
| logD: | 3.4655 |
| logSw: | -3.6552 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.237 |
| InChI Key: | QYWJMEQSEAAYHQ-UHFFFAOYSA-N |