3-(1-{2-[4-(sec-butyl)phenoxy]ethyl}-1H-pyrrol-2-yl)-2-cyano-N~1~-(1,3-thiazol-2-yl)acrylamide
Chemical Structure Depiction of
3-(1-{2-[4-(sec-butyl)phenoxy]ethyl}-1H-pyrrol-2-yl)-2-cyano-N~1~-(1,3-thiazol-2-yl)acrylamide
3-(1-{2-[4-(sec-butyl)phenoxy]ethyl}-1H-pyrrol-2-yl)-2-cyano-N~1~-(1,3-thiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | 5234-0833 |
| Compound Name: | 3-(1-{2-[4-(sec-butyl)phenoxy]ethyl}-1H-pyrrol-2-yl)-2-cyano-N~1~-(1,3-thiazol-2-yl)acrylamide |
| Molecular Weight: | 420.53 |
| Molecular Formula: | C23 H24 N4 O2 S |
| Smiles: | CCC(C)c1ccc(cc1)OCCn1cccc1/C=C(/C#N)C(Nc1nccs1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.66 |
| logD: | 5.6 |
| logSw: | -6.21 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 118.64 |
| InChI Key: | HVSNULGCTDKTHU-KRWDZBQOSA-N |