2-cyano-3-{1-[2-(3-methylphenoxy)ethyl]-1H-pyrrol-2-yl}-N~1~-(1,3-thiazol-2-yl)acrylamide
Chemical Structure Depiction of
2-cyano-3-{1-[2-(3-methylphenoxy)ethyl]-1H-pyrrol-2-yl}-N~1~-(1,3-thiazol-2-yl)acrylamide
2-cyano-3-{1-[2-(3-methylphenoxy)ethyl]-1H-pyrrol-2-yl}-N~1~-(1,3-thiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | 5234-0308 |
| Compound Name: | 2-cyano-3-{1-[2-(3-methylphenoxy)ethyl]-1H-pyrrol-2-yl}-N~1~-(1,3-thiazol-2-yl)acrylamide |
| Molecular Weight: | 378.45 |
| Molecular Formula: | C20 H18 N4 O2 S |
| Smiles: | Cc1cccc(c1)OCCn1cccc1/C=C(/C#N)C(Nc1nccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.22 |
| logD: | 4.16 |
| logSw: | -4.74 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 112.46 |
| InChI Key: | CQNNYMVXSMSIDS-UHFFFAOYSA-N |