6-[(4-bromophenoxy)methyl]-3-(4-tert-butylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
6-[(4-bromophenoxy)methyl]-3-(4-tert-butylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
6-[(4-bromophenoxy)methyl]-3-(4-tert-butylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | 7009-0279 |
| Compound Name: | 6-[(4-bromophenoxy)methyl]-3-(4-tert-butylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 443.36 |
| Molecular Formula: | C20 H19 Br N4 O S |
| Smiles: | CC(C)(C)c1ccc(cc1)c1nnc2n1nc(COc1ccc(cc1)[Br])s2 |
| Stereo: | ACHIRAL |
| logP: | 6.0725 |
| logD: | 6.0725 |
| logSw: | -5.6539 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 41.716 |
| InChI Key: | IDOWGESCAIEWCZ-UHFFFAOYSA-N |