2-cyano-3-{4-[2-(2,5-dimethylphenoxy)ethoxy]-3-ethoxyphenyl}-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide
Chemical Structure Depiction of
2-cyano-3-{4-[2-(2,5-dimethylphenoxy)ethoxy]-3-ethoxyphenyl}-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide
2-cyano-3-{4-[2-(2,5-dimethylphenoxy)ethoxy]-3-ethoxyphenyl}-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | 4277-0472 |
| Compound Name: | 2-cyano-3-{4-[2-(2,5-dimethylphenoxy)ethoxy]-3-ethoxyphenyl}-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide |
| Molecular Weight: | 478.57 |
| Molecular Formula: | C25 H26 N4 O4 S |
| Smiles: | CCOc1cc(/C=C(/C#N)C(Nc2nnc(C)s2)=O)ccc1OCCOc1cc(C)ccc1C |
| Stereo: | ACHIRAL |
| logP: | 4.61 |
| logD: | 2.65 |
| logSw: | -5.14 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 164.69 |
| InChI Key: | FJSQOQCIHVNHGS-UHFFFAOYSA-N |