3-[5-(benzylsulfanyl)-2-furyl]-N~1~-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-cyanoacrylamide
Chemical Structure Depiction of
3-[5-(benzylsulfanyl)-2-furyl]-N~1~-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-cyanoacrylamide
3-[5-(benzylsulfanyl)-2-furyl]-N~1~-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-cyanoacrylamide
Compound characteristics
| Compound ID: | C639-0422 |
| Compound Name: | 3-[5-(benzylsulfanyl)-2-furyl]-N~1~-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-cyanoacrylamide |
| Molecular Weight: | 490.62 |
| Molecular Formula: | C24 H18 N4 O2 S3 |
| Smiles: | C(c1ccccc1)Sc1ccc(/C=C(/C#N)C(Nc2nnc(SCc3ccccc3)s2)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 6.1 |
| logD: | 5.6 |
| logSw: | -6.84 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 217.13 |
| InChI Key: | RMTNQTGQAGOWSW-UHFFFAOYSA-N |