2-cyano-3-{4-[2-(2,4-dimethylphenoxy)ethoxy]-3-methoxyphenyl}-N~1~-(5-phenyl-1,3,4-thiadiazol-2-yl)acrylamide
Chemical Structure Depiction of
2-cyano-3-{4-[2-(2,4-dimethylphenoxy)ethoxy]-3-methoxyphenyl}-N~1~-(5-phenyl-1,3,4-thiadiazol-2-yl)acrylamide
2-cyano-3-{4-[2-(2,4-dimethylphenoxy)ethoxy]-3-methoxyphenyl}-N~1~-(5-phenyl-1,3,4-thiadiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | 4277-1136 |
| Compound Name: | 2-cyano-3-{4-[2-(2,4-dimethylphenoxy)ethoxy]-3-methoxyphenyl}-N~1~-(5-phenyl-1,3,4-thiadiazol-2-yl)acrylamide |
| Molecular Weight: | 526.61 |
| Molecular Formula: | C29 H26 N4 O4 S |
| Smiles: | Cc1ccc(c(C)c1)OCCOc1ccc(/C=C(/C#N)C(Nc2nnc(c3ccccc3)s2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 6.44 |
| logD: | 6.35 |
| logSw: | -7.22 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 161.34 |
| InChI Key: | IXHXQVQOFWOZPL-UHFFFAOYSA-N |