N-(2,5-dimethoxyphenyl)-5-(4-methylphenyl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
N-(2,5-dimethoxyphenyl)-5-(4-methylphenyl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
N-(2,5-dimethoxyphenyl)-5-(4-methylphenyl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
Compound ID: | J093-0455 |
Compound Name: | N-(2,5-dimethoxyphenyl)-5-(4-methylphenyl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide |
Molecular Weight: | 457.41 |
Molecular Formula: | C22 H18 F3 N5 O3 |
Smiles: | Cc1ccc(cc1)c1cc(C(F)(F)F)n2c(n1)nc(C(Nc1cc(ccc1OC)OC)=O)n2 |
Stereo: | ACHIRAL |
logP: | 4.718 |
logD: | 4.715 |
logSw: | -4.552 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 67.349 |
InChI Key: | YZVHCCAQVSMVHS-UHFFFAOYSA-N |