6-[2-(2-methoxyphenyl)ethenyl]-3-(pyridin-3-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
6-[2-(2-methoxyphenyl)ethenyl]-3-(pyridin-3-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
6-[2-(2-methoxyphenyl)ethenyl]-3-(pyridin-3-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
Compound ID: | D727-0084 |
Compound Name: | 6-[2-(2-methoxyphenyl)ethenyl]-3-(pyridin-3-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
Molecular Weight: | 335.39 |
Molecular Formula: | C17 H13 N5 O S |
Smiles: | COc1ccccc1/C=C/c1nn2c(c3cccnc3)nnc2s1 |
Stereo: | ACHIRAL |
logP: | 2.6348 |
logD: | 2.6345 |
logSw: | -2.5989 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 51.365 |
InChI Key: | RWNJMKSNYILDKQ-UHFFFAOYSA-N |