6-[3-(4-methoxyphenyl)-1H-pyrazol-4-yl]-3-(trifluoromethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
6-[3-(4-methoxyphenyl)-1H-pyrazol-4-yl]-3-(trifluoromethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
6-[3-(4-methoxyphenyl)-1H-pyrazol-4-yl]-3-(trifluoromethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
Compound ID: | 8020-5982 |
Compound Name: | 6-[3-(4-methoxyphenyl)-1H-pyrazol-4-yl]-3-(trifluoromethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
Molecular Weight: | 366.32 |
Molecular Formula: | C14 H9 F3 N6 O S |
Smiles: | COc1ccc(cc1)c1c(c[nH]n1)c1nn2c(C(F)(F)F)nnc2s1 |
Stereo: | ACHIRAL |
logP: | 2.718 |
logD: | 2.718 |
logSw: | -3.3109 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 65.727 |
InChI Key: | SXOOMRWVLVAYSV-UHFFFAOYSA-N |