2-cyano-N~1~-[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-[5-(phenylsulfanyl)-2-furyl]acrylamide
Chemical Structure Depiction of
2-cyano-N~1~-[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-[5-(phenylsulfanyl)-2-furyl]acrylamide
2-cyano-N~1~-[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-[5-(phenylsulfanyl)-2-furyl]acrylamide
Compound characteristics
| Compound ID: | C146-0534 |
| Compound Name: | 2-cyano-N~1~-[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-[5-(phenylsulfanyl)-2-furyl]acrylamide |
| Molecular Weight: | 400.5 |
| Molecular Formula: | C17 H12 N4 O2 S3 |
| Smiles: | CSc1nc(NC(C(=C/c2ccc(o2)Sc2ccccc2)\C#N)=O)sn1 |
| Stereo: | ACHIRAL |
| logP: | 5.11 |
| logD: | 4.42 |
| logSw: | -6.09 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 211.24 |
| InChI Key: | YEFLDHIQCOELBL-UHFFFAOYSA-N |