3-tert-butyl-6-(3-methoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
3-tert-butyl-6-(3-methoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
3-tert-butyl-6-(3-methoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | D221-0074 |
| Compound Name: | 3-tert-butyl-6-(3-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(c1cccc(c1)OC)s2 |
| Stereo: | ACHIRAL |
| logP: | 3.4087 |
| logD: | 3.4087 |
| logSw: | -3.7435 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 41.537 |
| InChI Key: | QJESNJQERQDFKQ-UHFFFAOYSA-N |