ethyl 7-(2,3-dimethoxyphenyl)-5-(trifluoromethyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 7-(2,3-dimethoxyphenyl)-5-(trifluoromethyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
ethyl 7-(2,3-dimethoxyphenyl)-5-(trifluoromethyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Compound characteristics
Compound ID: | K832-3611 |
Compound Name: | ethyl 7-(2,3-dimethoxyphenyl)-5-(trifluoromethyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate |
Molecular Weight: | 398.34 |
Molecular Formula: | C17 H17 F3 N4 O4 |
Smiles: | CCOC(C1C(c2cccc(c2OC)OC)n2c(NC=1C(F)(F)F)ncn2)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.8758 |
logD: | -1.3171 |
logSw: | -3.3011 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 74.592 |
InChI Key: | QEWPEMXZDHNPNK-GFCCVEGCSA-N |