3-[5-(2-chloro-4-nitrophenyl)-2-furyl]-2-cyano-N~1~-(4-phenyl-1,3-thiazol-2-yl)acrylamide
Chemical Structure Depiction of
3-[5-(2-chloro-4-nitrophenyl)-2-furyl]-2-cyano-N~1~-(4-phenyl-1,3-thiazol-2-yl)acrylamide
3-[5-(2-chloro-4-nitrophenyl)-2-furyl]-2-cyano-N~1~-(4-phenyl-1,3-thiazol-2-yl)acrylamide
Compound characteristics
Compound ID: | 4384-0060 |
Compound Name: | 3-[5-(2-chloro-4-nitrophenyl)-2-furyl]-2-cyano-N~1~-(4-phenyl-1,3-thiazol-2-yl)acrylamide |
Molecular Weight: | 476.9 |
Molecular Formula: | C23 H13 Cl N4 O4 S |
Smiles: | C(=C(/C#N)C(Nc1nc(cs1)c1ccccc1)=O)\c1ccc(c2ccc(cc2[Cl])[N+]([O-])=O)o1 |
Stereo: | ACHIRAL |
logP: | 6.63 |
logD: | 6.62 |
logSw: | -7.37 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 183.08 |
InChI Key: | JRFDAWYZCQVKAQ-UHFFFAOYSA-N |