3-{3-chloro-4-[2-(4-ethylphenoxy)ethoxy]phenyl}-2-cyano-N~1~-[3-(ethylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide
Chemical Structure Depiction of
3-{3-chloro-4-[2-(4-ethylphenoxy)ethoxy]phenyl}-2-cyano-N~1~-[3-(ethylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide
3-{3-chloro-4-[2-(4-ethylphenoxy)ethoxy]phenyl}-2-cyano-N~1~-[3-(ethylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide
Compound characteristics
| Compound ID: | C355-0821 |
| Compound Name: | 3-{3-chloro-4-[2-(4-ethylphenoxy)ethoxy]phenyl}-2-cyano-N~1~-[3-(ethylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide |
| Molecular Weight: | 547.05 |
| Molecular Formula: | C24 H23 Cl N4 O5 S2 |
| Smiles: | CCc1ccc(cc1)OCCOc1ccc(/C=C(/C#N)C(Nc2nc(ns2)S(CC)(=O)=O)=O)cc1[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.37 |
| logD: | 3.02 |
| logSw: | -6.32 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 205.22 |
| InChI Key: | PWSTWFCSCWETFH-UHFFFAOYSA-N |