2-cyano-3-[1-(4-fluorobenzyl)-1H-pyrrol-2-yl]-N~1~-(1,3-thiazol-2-yl)acrylamide
Chemical Structure Depiction of
2-cyano-3-[1-(4-fluorobenzyl)-1H-pyrrol-2-yl]-N~1~-(1,3-thiazol-2-yl)acrylamide
2-cyano-3-[1-(4-fluorobenzyl)-1H-pyrrol-2-yl]-N~1~-(1,3-thiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | 5234-0154 |
| Compound Name: | 2-cyano-3-[1-(4-fluorobenzyl)-1H-pyrrol-2-yl]-N~1~-(1,3-thiazol-2-yl)acrylamide |
| Molecular Weight: | 352.39 |
| Molecular Formula: | C18 H13 F N4 O S |
| Smiles: | C(c1ccc(cc1)F)n1cccc1/C=C(/C#N)C(Nc1nccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.56 |
| logD: | 3.49 |
| logSw: | -4.44 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 109.15 |
| InChI Key: | ZNGMLBQUVOMIJG-UVTDQMKNSA-N |