2-cyano-3-[5-(cyclohexylsulfanyl)-2-furyl]-N~1~-[3-(methylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide
Chemical Structure Depiction of
2-cyano-3-[5-(cyclohexylsulfanyl)-2-furyl]-N~1~-[3-(methylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide
2-cyano-3-[5-(cyclohexylsulfanyl)-2-furyl]-N~1~-[3-(methylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide
Compound characteristics
| Compound ID: | C508-0586 |
| Compound Name: | 2-cyano-3-[5-(cyclohexylsulfanyl)-2-furyl]-N~1~-[3-(methylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide |
| Molecular Weight: | 438.54 |
| Molecular Formula: | C17 H18 N4 O4 S3 |
| Smiles: | CS(c1nc(NC(C(=C/c2ccc(o2)SC2CCCCC2)\C#N)=O)sn1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.03 |
| logD: | 1.66 |
| logSw: | -4.9 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 259.4 |
| InChI Key: | QPYCGSSYYZGRSN-UHFFFAOYSA-N |