2-cyano-3-[5-(2-methyl-5-nitrophenyl)-2-furyl]-N~1~-(4-methyl-1,3-thiazol-2-yl)acrylamide
Chemical Structure Depiction of
2-cyano-3-[5-(2-methyl-5-nitrophenyl)-2-furyl]-N~1~-(4-methyl-1,3-thiazol-2-yl)acrylamide
2-cyano-3-[5-(2-methyl-5-nitrophenyl)-2-furyl]-N~1~-(4-methyl-1,3-thiazol-2-yl)acrylamide
Compound characteristics
Compound ID: | C508-0410 |
Compound Name: | 2-cyano-3-[5-(2-methyl-5-nitrophenyl)-2-furyl]-N~1~-(4-methyl-1,3-thiazol-2-yl)acrylamide |
Molecular Weight: | 394.41 |
Molecular Formula: | C19 H14 N4 O4 S |
Smiles: | Cc1ccc(cc1c1ccc(/C=C(/C#N)C(Nc2nc(C)cs2)=O)o1)[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 4.63 |
logD: | 3.56 |
logSw: | -5.41 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 194.76 |
InChI Key: | VYOFVJDITFPYKK-UHFFFAOYSA-N |