2-cyano-N~1~-[3-(methylsulfonyl)-1,2,4-thiadiazol-5-yl]-3-[5-(phenylsulfanyl)-2-furyl]acrylamide
Chemical Structure Depiction of
2-cyano-N~1~-[3-(methylsulfonyl)-1,2,4-thiadiazol-5-yl]-3-[5-(phenylsulfanyl)-2-furyl]acrylamide
2-cyano-N~1~-[3-(methylsulfonyl)-1,2,4-thiadiazol-5-yl]-3-[5-(phenylsulfanyl)-2-furyl]acrylamide
Compound characteristics
| Compound ID: | C355-0239 |
| Compound Name: | 2-cyano-N~1~-[3-(methylsulfonyl)-1,2,4-thiadiazol-5-yl]-3-[5-(phenylsulfanyl)-2-furyl]acrylamide |
| Molecular Weight: | 432.5 |
| Molecular Formula: | C17 H12 N4 O4 S3 |
| Smiles: | CS(c1nc(NC(C(=C/c2ccc(o2)Sc2ccccc2)\C#N)=O)sn1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.44 |
| logD: | 1.07 |
| logSw: | -4.29 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 241.87 |
| InChI Key: | FFLSOZHBZVNWFY-UHFFFAOYSA-N |