N-(3-methoxyphenyl)-2-(methylsulfanyl)-4-(trifluoromethyl)pyrimidine-5-carboxamide
Chemical Structure Depiction of
N-(3-methoxyphenyl)-2-(methylsulfanyl)-4-(trifluoromethyl)pyrimidine-5-carboxamide
N-(3-methoxyphenyl)-2-(methylsulfanyl)-4-(trifluoromethyl)pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | E727-0682 |
| Compound Name: | N-(3-methoxyphenyl)-2-(methylsulfanyl)-4-(trifluoromethyl)pyrimidine-5-carboxamide |
| Molecular Weight: | 343.32 |
| Molecular Formula: | C14 H12 F3 N3 O2 S |
| Smiles: | COc1cccc(c1)NC(c1cnc(nc1C(F)(F)F)SC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2404 |
| logD: | 2.3268 |
| logSw: | -3.6422 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.459 |
| InChI Key: | BONZPCWDAYXYII-UHFFFAOYSA-N |