3-(3,4-dimethoxyphenyl)-6-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
3-(3,4-dimethoxyphenyl)-6-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
3-(3,4-dimethoxyphenyl)-6-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | 8020-0952 |
| Compound Name: | 3-(3,4-dimethoxyphenyl)-6-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 434.48 |
| Molecular Formula: | C21 H18 N6 O3 S |
| Smiles: | COc1ccc(cc1)c1cc(c2nn3c(c4ccc(c(c4)OC)OC)nnc3s2)n[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 3.8488 |
| logD: | 3.8488 |
| logSw: | -4.1196 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.016 |
| InChI Key: | LEYLGLBCJQILRV-UHFFFAOYSA-N |