5-chloro-N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(methylsulfanyl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(methylsulfanyl)pyrimidine-4-carboxamide
5-chloro-N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(methylsulfanyl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D054-0192 |
| Compound Name: | 5-chloro-N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(methylsulfanyl)pyrimidine-4-carboxamide |
| Molecular Weight: | 382.19 |
| Molecular Formula: | C13 H8 Cl2 F3 N3 O S |
| Smiles: | [H]N(C(c1c(cnc(n1)SC)[Cl])=O)c1ccc(c(c1)C(F)(F)F)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.9466 |
| logD: | 3.3318 |
| logSw: | -5.0457 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.915 |
| InChI Key: | ZBETXRPVQNLDCI-UHFFFAOYSA-N |