5-chloro-2-(propylsulfanyl)-N-[2-(trifluoromethyl)phenyl]pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-2-(propylsulfanyl)-N-[2-(trifluoromethyl)phenyl]pyrimidine-4-carboxamide
5-chloro-2-(propylsulfanyl)-N-[2-(trifluoromethyl)phenyl]pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D054-0390 |
| Compound Name: | 5-chloro-2-(propylsulfanyl)-N-[2-(trifluoromethyl)phenyl]pyrimidine-4-carboxamide |
| Molecular Weight: | 375.8 |
| Molecular Formula: | C15 H13 Cl F3 N3 O S |
| Smiles: | [H]N(C(c1c(cnc(n1)SCCC)[Cl])=O)c1ccccc1C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 4.785 |
| logD: | 4.7831 |
| logSw: | -4.8428 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.217 |
| InChI Key: | WRSSLFQVFBNCOV-UHFFFAOYSA-N |