3-(phenoxymethyl)-6-[2-(thiophen-2-yl)ethenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
3-(phenoxymethyl)-6-[2-(thiophen-2-yl)ethenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
3-(phenoxymethyl)-6-[2-(thiophen-2-yl)ethenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | D731-0772 |
| Compound Name: | 3-(phenoxymethyl)-6-[2-(thiophen-2-yl)ethenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 340.42 |
| Molecular Formula: | C16 H12 N4 O S2 |
| Smiles: | C(c1nnc2n1nc(/C=C/c1cccs1)s2)Oc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.8533 |
| logD: | 2.8533 |
| logSw: | -3.0606 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 43.71 |
| InChI Key: | AIIIDYFYBJBJNK-UHFFFAOYSA-N |