3-(4-ethoxyphenyl)-5-[(5-methylfuran-2-yl)methylidene]-2-(3-nitrophenyl)-1lambda~6~,3-thiazolidine-1,1,4-trione
Chemical Structure Depiction of
3-(4-ethoxyphenyl)-5-[(5-methylfuran-2-yl)methylidene]-2-(3-nitrophenyl)-1lambda~6~,3-thiazolidine-1,1,4-trione
3-(4-ethoxyphenyl)-5-[(5-methylfuran-2-yl)methylidene]-2-(3-nitrophenyl)-1lambda~6~,3-thiazolidine-1,1,4-trione
Compound characteristics
Compound ID: | K506-0015 |
Compound Name: | 3-(4-ethoxyphenyl)-5-[(5-methylfuran-2-yl)methylidene]-2-(3-nitrophenyl)-1lambda~6~,3-thiazolidine-1,1,4-trione |
Molecular Weight: | 468.48 |
Molecular Formula: | C23 H20 N2 O7 S |
Smiles: | CCOc1ccc(cc1)N1C(c2cccc(c2)[N+]([O-])=O)S(C(=C\c2ccc(C)o2)\C1=O)(=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.0853 |
logD: | 4.0853 |
logSw: | -4.2347 |
Hydrogen bond acceptors count: | 12 |
Polar surface area: | 92.305 |
InChI Key: | KHPYYFTYTXXCLL-QHCPKHFHSA-N |