3-(3,4-dimethoxyphenyl)-6-(1,3,5-trimethyl-1H-pyrazol-4-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
3-(3,4-dimethoxyphenyl)-6-(1,3,5-trimethyl-1H-pyrazol-4-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
3-(3,4-dimethoxyphenyl)-6-(1,3,5-trimethyl-1H-pyrazol-4-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
Compound ID: | 8020-3136 |
Compound Name: | 3-(3,4-dimethoxyphenyl)-6-(1,3,5-trimethyl-1H-pyrazol-4-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
Molecular Weight: | 370.43 |
Molecular Formula: | C17 H18 N6 O2 S |
Smiles: | Cc1c(c(C)n(C)n1)c1nn2c(c3ccc(c(c3)OC)OC)nnc2s1 |
Stereo: | ACHIRAL |
logP: | 1.54 |
logD: | 1.5399 |
logSw: | -2.1519 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 63.822 |
InChI Key: | YUPFQOXKAHUJIM-UHFFFAOYSA-N |