2-cyano-3-[5-(cyclohexylsulfanyl)-2-furyl]-N~1~-[5-(2-furyl)-1,3,4-thiadiazol-2-yl]acrylamide
Chemical Structure Depiction of
2-cyano-3-[5-(cyclohexylsulfanyl)-2-furyl]-N~1~-[5-(2-furyl)-1,3,4-thiadiazol-2-yl]acrylamide
2-cyano-3-[5-(cyclohexylsulfanyl)-2-furyl]-N~1~-[5-(2-furyl)-1,3,4-thiadiazol-2-yl]acrylamide
Compound characteristics
| Compound ID: | C508-0343 |
| Compound Name: | 2-cyano-3-[5-(cyclohexylsulfanyl)-2-furyl]-N~1~-[5-(2-furyl)-1,3,4-thiadiazol-2-yl]acrylamide |
| Molecular Weight: | 426.51 |
| Molecular Formula: | C20 H18 N4 O3 S2 |
| Smiles: | C1CCC(CC1)Sc1ccc(/C=C(/C#N)C(Nc2nnc(c3ccco3)s2)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 5.65 |
| logD: | 5.55 |
| logSw: | -6.59 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 205.61 |
| InChI Key: | MFEGHIZPTCILDZ-UHFFFAOYSA-N |