3-{1-[2-(2-allylphenoxy)ethyl]-1H-pyrrol-2-yl}-2-cyano-N~1~-(4-phenyl-1,3-thiazol-2-yl)acrylamide
Chemical Structure Depiction of
3-{1-[2-(2-allylphenoxy)ethyl]-1H-pyrrol-2-yl}-2-cyano-N~1~-(4-phenyl-1,3-thiazol-2-yl)acrylamide
3-{1-[2-(2-allylphenoxy)ethyl]-1H-pyrrol-2-yl}-2-cyano-N~1~-(4-phenyl-1,3-thiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | 5234-2527 |
| Compound Name: | 3-{1-[2-(2-allylphenoxy)ethyl]-1H-pyrrol-2-yl}-2-cyano-N~1~-(4-phenyl-1,3-thiazol-2-yl)acrylamide |
| Molecular Weight: | 480.59 |
| Molecular Formula: | C28 H24 N4 O2 S |
| Smiles: | C=CCc1ccccc1OCCn1cccc1/C=C(/C#N)C(Nc1nc(cs1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.93 |
| logD: | 6.93 |
| logSw: | -7.38 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.2 |
| InChI Key: | ZWVODOBHYCRUCB-UHFFFAOYSA-N |