5-chloro-2-(ethanesulfonyl)-N-[2-(trifluoromethyl)phenyl]pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-2-(ethanesulfonyl)-N-[2-(trifluoromethyl)phenyl]pyrimidine-4-carboxamide
5-chloro-2-(ethanesulfonyl)-N-[2-(trifluoromethyl)phenyl]pyrimidine-4-carboxamide
Compound characteristics
Compound ID: | D053-0085 |
Compound Name: | 5-chloro-2-(ethanesulfonyl)-N-[2-(trifluoromethyl)phenyl]pyrimidine-4-carboxamide |
Molecular Weight: | 393.77 |
Molecular Formula: | C14 H11 Cl F3 N3 O3 S |
Smiles: | [H]N(C(c1c(cnc(n1)S(CC)(=O)=O)[Cl])=O)c1ccccc1C(F)(F)F |
Stereo: | ACHIRAL |
logP: | 3.0344 |
logD: | 3.0108 |
logSw: | -3.6851 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 71.081 |
InChI Key: | AMYAOQUAKXYLCP-UHFFFAOYSA-N |