2-cyano-3-{5-[(4-methylphenyl)sulfanyl]-2-furyl}-N~1~-[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]acrylamide
Chemical Structure Depiction of
2-cyano-3-{5-[(4-methylphenyl)sulfanyl]-2-furyl}-N~1~-[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]acrylamide
2-cyano-3-{5-[(4-methylphenyl)sulfanyl]-2-furyl}-N~1~-[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]acrylamide
Compound characteristics
| Compound ID: | C146-0108 |
| Compound Name: | 2-cyano-3-{5-[(4-methylphenyl)sulfanyl]-2-furyl}-N~1~-[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]acrylamide |
| Molecular Weight: | 414.52 |
| Molecular Formula: | C18 H14 N4 O2 S3 |
| Smiles: | Cc1ccc(cc1)Sc1ccc(/C=C(/C#N)C(Nc2nc(ns2)SC)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 5.72 |
| logD: | 5.03 |
| logSw: | -6.46 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 214.55 |
| InChI Key: | MSCFJAXCMKJBBF-UHFFFAOYSA-N |