3-[(3-methylphenoxy)methyl]-6-[2-(thiophen-2-yl)ethenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
3-[(3-methylphenoxy)methyl]-6-[2-(thiophen-2-yl)ethenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
3-[(3-methylphenoxy)methyl]-6-[2-(thiophen-2-yl)ethenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | D228-0323 |
| Compound Name: | 3-[(3-methylphenoxy)methyl]-6-[2-(thiophen-2-yl)ethenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 354.45 |
| Molecular Formula: | C17 H14 N4 O S2 |
| Smiles: | Cc1cccc(c1)OCc1nnc2n1nc(/C=C/c1cccs1)s2 |
| Stereo: | ACHIRAL |
| logP: | 3.3731 |
| logD: | 3.3731 |
| logSw: | -3.5145 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 43.71 |
| InChI Key: | NMQCPGAYBROTFD-UHFFFAOYSA-N |