2-cyano-3-{3-[2-(2,5-dimethylphenoxy)ethoxy]phenyl}-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide
Chemical Structure Depiction of
2-cyano-3-{3-[2-(2,5-dimethylphenoxy)ethoxy]phenyl}-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide
2-cyano-3-{3-[2-(2,5-dimethylphenoxy)ethoxy]phenyl}-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | 4277-0164 |
| Compound Name: | 2-cyano-3-{3-[2-(2,5-dimethylphenoxy)ethoxy]phenyl}-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide |
| Molecular Weight: | 434.52 |
| Molecular Formula: | C23 H22 N4 O3 S |
| Smiles: | Cc1ccc(C)c(c1)OCCOc1cccc(/C=C(/C#N)C(Nc2nnc(C)s2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.77 |
| logD: | 2.82 |
| logSw: | -5.43 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 167.27 |
| InChI Key: | CTQVPHZJDVUXRM-UHFFFAOYSA-N |