2-cyano-3-[5-(cyclohexylsulfanyl)-2-furyl]-N~1~-(5-phenyl-1,3,4-thiadiazol-2-yl)acrylamide
Chemical Structure Depiction of
2-cyano-3-[5-(cyclohexylsulfanyl)-2-furyl]-N~1~-(5-phenyl-1,3,4-thiadiazol-2-yl)acrylamide
2-cyano-3-[5-(cyclohexylsulfanyl)-2-furyl]-N~1~-(5-phenyl-1,3,4-thiadiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | C508-0298 |
| Compound Name: | 2-cyano-3-[5-(cyclohexylsulfanyl)-2-furyl]-N~1~-(5-phenyl-1,3,4-thiadiazol-2-yl)acrylamide |
| Molecular Weight: | 436.55 |
| Molecular Formula: | C22 H20 N4 O2 S2 |
| Smiles: | C1CCC(CC1)Sc1ccc(/C=C(/C#N)C(Nc2nnc(c3ccccc3)s2)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 6.43 |
| logD: | 6.34 |
| logSw: | -7.14 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 194.47 |
| InChI Key: | ZPQSPEWUSRGSQB-UHFFFAOYSA-N |