ethyl 7-[4-(difluoromethoxy)-3-ethoxyphenyl]-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 7-[4-(difluoromethoxy)-3-ethoxyphenyl]-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
ethyl 7-[4-(difluoromethoxy)-3-ethoxyphenyl]-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Compound characteristics
Compound ID: | K832-4161 |
Compound Name: | ethyl 7-[4-(difluoromethoxy)-3-ethoxyphenyl]-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate |
Molecular Weight: | 394.38 |
Molecular Formula: | C18 H20 F2 N4 O4 |
Smiles: | CCOC(C1C(c2ccc(c(c2)OCC)OC(F)F)n2c(NC=1C)ncn2)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.4287 |
logD: | 2.1404 |
logSw: | -2.9526 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 72.646 |
InChI Key: | CBTFTOYKVURLOF-HNNXBMFYSA-N |