6-[2-(furan-2-yl)ethenyl]-3-(4-methylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
6-[2-(furan-2-yl)ethenyl]-3-(4-methylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
6-[2-(furan-2-yl)ethenyl]-3-(4-methylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | D064-0045 |
| Compound Name: | 6-[2-(furan-2-yl)ethenyl]-3-(4-methylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 308.36 |
| Molecular Formula: | C16 H12 N4 O S |
| Smiles: | Cc1ccc(cc1)c1nnc2n1nc(/C=C/c1ccco1)s2 |
| Stereo: | ACHIRAL |
| logP: | 3.568 |
| logD: | 3.568 |
| logSw: | -3.5643 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 41.966 |
| InChI Key: | OAQRUJBHJBGDBS-CMDGGOBGSA-N |