3-[(4-methoxyphenyl)methyl]-6-phenyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
3-[(4-methoxyphenyl)methyl]-6-phenyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
3-[(4-methoxyphenyl)methyl]-6-phenyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | D228-1378 |
| Compound Name: | 3-[(4-methoxyphenyl)methyl]-6-phenyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 322.39 |
| Molecular Formula: | C17 H14 N4 O S |
| Smiles: | COc1ccc(Cc2nnc3n2nc(c2ccccc2)s3)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.2199 |
| logD: | 3.2199 |
| logSw: | -3.2602 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 42.242 |
| InChI Key: | LAKSIHJCMOVJCG-UHFFFAOYSA-N |