3-[(4-bromophenoxy)methyl]-6-(thiophen-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
3-[(4-bromophenoxy)methyl]-6-(thiophen-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
3-[(4-bromophenoxy)methyl]-6-(thiophen-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | D727-0450 |
| Compound Name: | 3-[(4-bromophenoxy)methyl]-6-(thiophen-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 393.28 |
| Molecular Formula: | C14 H9 Br N4 O S2 |
| Smiles: | C(c1nnc2n1nc(c1cccs1)s2)Oc1ccc(cc1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.8117 |
| logD: | 3.8117 |
| logSw: | -4.0687 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 43.215 |
| InChI Key: | AXDAZKCEFLOYTD-UHFFFAOYSA-N |