3-benzyl-6-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
3-benzyl-6-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
3-benzyl-6-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | D228-1590 |
| Compound Name: | 3-benzyl-6-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 352.48 |
| Molecular Formula: | C18 H16 N4 S2 |
| Smiles: | C1CCc2c(C1)c(cs2)c1nn2c(Cc3ccccc3)nnc2s1 |
| Stereo: | ACHIRAL |
| logP: | 4.293 |
| logD: | 4.293 |
| logSw: | -4.5895 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 35.637 |
| InChI Key: | GHMMCPSDVMAMCU-UHFFFAOYSA-N |