2-cyano-3-[5-(4-ethoxy-2-nitrophenyl)-2-furyl]-N~1~-(5-methyl-1,3-thiazol-2-yl)acrylamide
Chemical Structure Depiction of
2-cyano-3-[5-(4-ethoxy-2-nitrophenyl)-2-furyl]-N~1~-(5-methyl-1,3-thiazol-2-yl)acrylamide
2-cyano-3-[5-(4-ethoxy-2-nitrophenyl)-2-furyl]-N~1~-(5-methyl-1,3-thiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | C508-0798 |
| Compound Name: | 2-cyano-3-[5-(4-ethoxy-2-nitrophenyl)-2-furyl]-N~1~-(5-methyl-1,3-thiazol-2-yl)acrylamide |
| Molecular Weight: | 424.43 |
| Molecular Formula: | C20 H16 N4 O5 S |
| Smiles: | CCOc1ccc(c(c1)[N+]([O-])=O)c1ccc(/C=C(/C#N)C(Nc2ncc(C)s2)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 5.23 |
| logD: | 4.16 |
| logSw: | -6.26 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 211.29 |
| InChI Key: | XLHOISLLRGBNOR-UHFFFAOYSA-N |