3-[1-(2-chlorobenzyl)-1H-pyrrol-2-yl]-2-cyano-N~1~-(4-phenyl-1,3-thiazol-2-yl)acrylamide
Chemical Structure Depiction of
3-[1-(2-chlorobenzyl)-1H-pyrrol-2-yl]-2-cyano-N~1~-(4-phenyl-1,3-thiazol-2-yl)acrylamide
3-[1-(2-chlorobenzyl)-1H-pyrrol-2-yl]-2-cyano-N~1~-(4-phenyl-1,3-thiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | 5234-1362 |
| Compound Name: | 3-[1-(2-chlorobenzyl)-1H-pyrrol-2-yl]-2-cyano-N~1~-(4-phenyl-1,3-thiazol-2-yl)acrylamide |
| Molecular Weight: | 444.94 |
| Molecular Formula: | C24 H17 Cl N4 O S |
| Smiles: | C(c1ccccc1[Cl])n1cccc1/C=C(/C#N)C(Nc1nc(cs1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.42 |
| logD: | 6.42 |
| logSw: | -7.16 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.58 |
| InChI Key: | BHDWHHCRZXDNSC-UHFFFAOYSA-N |