3-tert-butyl-6-(2-methoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
3-tert-butyl-6-(2-methoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
3-tert-butyl-6-(2-methoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | D221-0068 |
| Compound Name: | 3-tert-butyl-6-(2-methoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 288.37 |
| Molecular Formula: | C14 H16 N4 O S |
| Smiles: | CC(C)(C)c1nnc2n1nc(c1ccccc1OC)s2 |
| Stereo: | ACHIRAL |
| logP: | 3.1121 |
| logD: | 3.1121 |
| logSw: | -3.4528 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 41.624 |
| InChI Key: | DKXPIBKBBVRDPC-UHFFFAOYSA-N |