3-(3,4-dimethoxyphenyl)-6-[2-(4-methylphenyl)ethenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
3-(3,4-dimethoxyphenyl)-6-[2-(4-methylphenyl)ethenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
3-(3,4-dimethoxyphenyl)-6-[2-(4-methylphenyl)ethenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | 8019-9868 |
| Compound Name: | 3-(3,4-dimethoxyphenyl)-6-[2-(4-methylphenyl)ethenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 378.45 |
| Molecular Formula: | C20 H18 N4 O2 S |
| Smiles: | Cc1ccc(/C=C/c2nn3c(c4ccc(c(c4)OC)OC)nnc3s2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.0458 |
| logD: | 4.0458 |
| logSw: | -4.2146 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.478 |
| InChI Key: | OFNLLZVDOUKEKM-UHFFFAOYSA-N |