N-(2,4-difluorophenyl)-5-(thiophen-2-yl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
N-(2,4-difluorophenyl)-5-(thiophen-2-yl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
N-(2,4-difluorophenyl)-5-(thiophen-2-yl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
Compound ID: | J093-0900 |
Compound Name: | N-(2,4-difluorophenyl)-5-(thiophen-2-yl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide |
Molecular Weight: | 425.34 |
Molecular Formula: | C17 H8 F5 N5 O S |
Smiles: | c1cc(c2cc(C(F)(F)F)n3c(n2)nc(C(Nc2ccc(cc2F)F)=O)n3)sc1 |
Stereo: | ACHIRAL |
logP: | 4.1712 |
logD: | 4.1192 |
logSw: | -4.3167 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 53.193 |
InChI Key: | DLESOHITIAMMQS-UHFFFAOYSA-N |