N-(2-ethoxyphenyl)-5-(4-fluorophenyl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
N-(2-ethoxyphenyl)-5-(4-fluorophenyl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
N-(2-ethoxyphenyl)-5-(4-fluorophenyl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
Compound ID: | J093-0097 |
Compound Name: | N-(2-ethoxyphenyl)-5-(4-fluorophenyl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide |
Molecular Weight: | 445.37 |
Molecular Formula: | C21 H15 F4 N5 O2 |
Smiles: | CCOc1ccccc1NC(c1nc2nc(cc(C(F)(F)F)n2n1)c1ccc(cc1)F)=O |
Stereo: | ACHIRAL |
logP: | 4.8149 |
logD: | 4.8146 |
logSw: | -4.4996 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 59.385 |
InChI Key: | LGXTZIFSLOTRSK-UHFFFAOYSA-N |