3-{4-[2-(2-allylphenoxy)ethoxy]-3-methoxyphenyl}-2-cyano-N~1~-(4-phenyl-1,3-thiazol-2-yl)acrylamide
Chemical Structure Depiction of
3-{4-[2-(2-allylphenoxy)ethoxy]-3-methoxyphenyl}-2-cyano-N~1~-(4-phenyl-1,3-thiazol-2-yl)acrylamide
3-{4-[2-(2-allylphenoxy)ethoxy]-3-methoxyphenyl}-2-cyano-N~1~-(4-phenyl-1,3-thiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | 4384-0241 |
| Compound Name: | 3-{4-[2-(2-allylphenoxy)ethoxy]-3-methoxyphenyl}-2-cyano-N~1~-(4-phenyl-1,3-thiazol-2-yl)acrylamide |
| Molecular Weight: | 537.64 |
| Molecular Formula: | C31 H27 N3 O4 S |
| Smiles: | COc1cc(/C=C(/C#N)C(Nc2nc(cs2)c2ccccc2)=O)ccc1OCCOc1ccccc1CC=C |
| Stereo: | ACHIRAL |
| logP: | 7.14 |
| logD: | 7.13 |
| logSw: | -7.64 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 116.41 |
| InChI Key: | NIMRQWIAHRYJQK-UHFFFAOYSA-N |