2-cyano-3-{1-[2-(2,4-dimethylphenoxy)ethyl]-1H-indol-3-yl}-N~1~-[3-(methylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide
Chemical Structure Depiction of
2-cyano-3-{1-[2-(2,4-dimethylphenoxy)ethyl]-1H-indol-3-yl}-N~1~-[3-(methylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide
2-cyano-3-{1-[2-(2,4-dimethylphenoxy)ethyl]-1H-indol-3-yl}-N~1~-[3-(methylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide
Compound characteristics
| Compound ID: | C355-0142 |
| Compound Name: | 2-cyano-3-{1-[2-(2,4-dimethylphenoxy)ethyl]-1H-indol-3-yl}-N~1~-[3-(methylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide |
| Molecular Weight: | 521.62 |
| Molecular Formula: | C25 H23 N5 O4 S2 |
| Smiles: | Cc1ccc(c(C)c1)OCCn1cc(/C=C(/C#N)C(Nc2nc(ns2)S(C)(=O)=O)=O)c2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 4.62 |
| logD: | 1.84 |
| logSw: | -4.94 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 198.35 |
| InChI Key: | HMDODXOFPJASFJ-UHFFFAOYSA-N |