3-[5-(benzylsulfanyl)-2-furyl]-2-cyano-N~1~-[5-(2-furyl)-1,3,4-thiadiazol-2-yl]acrylamide
Chemical Structure Depiction of
3-[5-(benzylsulfanyl)-2-furyl]-2-cyano-N~1~-[5-(2-furyl)-1,3,4-thiadiazol-2-yl]acrylamide
3-[5-(benzylsulfanyl)-2-furyl]-2-cyano-N~1~-[5-(2-furyl)-1,3,4-thiadiazol-2-yl]acrylamide
Compound characteristics
| Compound ID: | C639-0382 |
| Compound Name: | 3-[5-(benzylsulfanyl)-2-furyl]-2-cyano-N~1~-[5-(2-furyl)-1,3,4-thiadiazol-2-yl]acrylamide |
| Molecular Weight: | 434.49 |
| Molecular Formula: | C21 H14 N4 O3 S2 |
| Smiles: | C(c1ccccc1)Sc1ccc(/C=C(/C#N)C(Nc2nnc(c3ccco3)s2)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 4.83 |
| logD: | 4.73 |
| logSw: | -5.58 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 190.33 |
| InChI Key: | OQJVBZDSWHFCCW-UHFFFAOYSA-N |