6-[(4-methoxyphenoxy)methyl]-3-(4-methylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
6-[(4-methoxyphenoxy)methyl]-3-(4-methylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
6-[(4-methoxyphenoxy)methyl]-3-(4-methylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | D064-0039 |
| Compound Name: | 6-[(4-methoxyphenoxy)methyl]-3-(4-methylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 352.41 |
| Molecular Formula: | C18 H16 N4 O2 S |
| Smiles: | Cc1ccc(cc1)c1nnc2n1nc(COc1ccc(cc1)OC)s2 |
| Stereo: | ACHIRAL |
| logP: | 3.8499 |
| logD: | 3.8499 |
| logSw: | -3.9819 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.26 |
| InChI Key: | IOXKXYMGWCBGHW-UHFFFAOYSA-N |