3-benzyl-6-[(4-methoxyphenyl)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
3-benzyl-6-[(4-methoxyphenyl)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
3-benzyl-6-[(4-methoxyphenyl)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | 7009-0818 |
| Compound Name: | 3-benzyl-6-[(4-methoxyphenyl)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 336.41 |
| Molecular Formula: | C18 H16 N4 O S |
| Smiles: | COc1ccc(Cc2nn3c(Cc4ccccc4)nnc3s2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.2483 |
| logD: | 3.2483 |
| logSw: | -3.3451 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 42.737 |
| InChI Key: | VUTSYQMQLRWTLC-UHFFFAOYSA-N |