3-[(4-methoxyphenyl)methyl]-6-[2-(thiophen-2-yl)ethenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
3-[(4-methoxyphenyl)methyl]-6-[2-(thiophen-2-yl)ethenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
3-[(4-methoxyphenyl)methyl]-6-[2-(thiophen-2-yl)ethenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | D228-1039 |
| Compound Name: | 3-[(4-methoxyphenyl)methyl]-6-[2-(thiophen-2-yl)ethenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 354.45 |
| Molecular Formula: | C17 H14 N4 O S2 |
| Smiles: | COc1ccc(Cc2nnc3n2nc(/C=C/c2cccs2)s3)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.0789 |
| logD: | 3.0789 |
| logSw: | -3.136 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 43.755 |
| InChI Key: | WHNZYOPZCADHKY-UHFFFAOYSA-N |