3-[5-(benzylsulfanyl)-2-furyl]-2-cyano-N~1~-[3-(isopropylsulfanyl)-1,2,4-thiadiazol-5-yl]acrylamide
Chemical Structure Depiction of
3-[5-(benzylsulfanyl)-2-furyl]-2-cyano-N~1~-[3-(isopropylsulfanyl)-1,2,4-thiadiazol-5-yl]acrylamide
3-[5-(benzylsulfanyl)-2-furyl]-2-cyano-N~1~-[3-(isopropylsulfanyl)-1,2,4-thiadiazol-5-yl]acrylamide
Compound characteristics
| Compound ID: | C639-0502 |
| Compound Name: | 3-[5-(benzylsulfanyl)-2-furyl]-2-cyano-N~1~-[3-(isopropylsulfanyl)-1,2,4-thiadiazol-5-yl]acrylamide |
| Molecular Weight: | 442.58 |
| Molecular Formula: | C20 H18 N4 O2 S3 |
| Smiles: | CC(C)Sc1nc(NC(C(=C/c2ccc(o2)SCc2ccccc2)\C#N)=O)sn1 |
| Stereo: | ACHIRAL |
| logP: | 5.68 |
| logD: | 4.99 |
| logSw: | -6.38 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 205.32 |
| InChI Key: | UGHLUANMFJELRW-UHFFFAOYSA-N |