N-[(2-methoxyphenyl)methyl]-2-(methylsulfanyl)-4-(trifluoromethyl)pyrimidine-5-carboxamide
Chemical Structure Depiction of
N-[(2-methoxyphenyl)methyl]-2-(methylsulfanyl)-4-(trifluoromethyl)pyrimidine-5-carboxamide
N-[(2-methoxyphenyl)methyl]-2-(methylsulfanyl)-4-(trifluoromethyl)pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | E727-0755 |
| Compound Name: | N-[(2-methoxyphenyl)methyl]-2-(methylsulfanyl)-4-(trifluoromethyl)pyrimidine-5-carboxamide |
| Molecular Weight: | 357.35 |
| Molecular Formula: | C15 H14 F3 N3 O2 S |
| Smiles: | COc1ccccc1CNC(c1cnc(nc1C(F)(F)F)SC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3589 |
| logD: | 3.2634 |
| logSw: | -3.5723 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.868 |
| InChI Key: | OPVNXRBZETULAC-UHFFFAOYSA-N |