N-(2-ethyl-6-methylphenyl)-5-(furan-2-yl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
N-(2-ethyl-6-methylphenyl)-5-(furan-2-yl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
N-(2-ethyl-6-methylphenyl)-5-(furan-2-yl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
Compound ID: | J093-0707 |
Compound Name: | N-(2-ethyl-6-methylphenyl)-5-(furan-2-yl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide |
Molecular Weight: | 415.37 |
Molecular Formula: | C20 H16 F3 N5 O2 |
Smiles: | CCc1cccc(C)c1NC(c1nc2nc(cc(C(F)(F)F)n2n1)c1ccco1)=O |
Stereo: | ACHIRAL |
logP: | 3.8506 |
logD: | 3.8506 |
logSw: | -3.8579 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 60.055 |
InChI Key: | PYZQRVOBTRFOJK-UHFFFAOYSA-N |