3-(4-ethoxyphenyl)-5-[(3-fluorophenyl)methylidene]-2-(3-nitrophenyl)-1lambda~6~,3-thiazolidine-1,1,4-trione
Chemical Structure Depiction of
3-(4-ethoxyphenyl)-5-[(3-fluorophenyl)methylidene]-2-(3-nitrophenyl)-1lambda~6~,3-thiazolidine-1,1,4-trione
3-(4-ethoxyphenyl)-5-[(3-fluorophenyl)methylidene]-2-(3-nitrophenyl)-1lambda~6~,3-thiazolidine-1,1,4-trione
Compound characteristics
Compound ID: | K506-0007 |
Compound Name: | 3-(4-ethoxyphenyl)-5-[(3-fluorophenyl)methylidene]-2-(3-nitrophenyl)-1lambda~6~,3-thiazolidine-1,1,4-trione |
Molecular Weight: | 482.49 |
Molecular Formula: | C24 H19 F N2 O6 S |
Smiles: | CCOc1ccc(cc1)N1C(c2cccc(c2)[N+]([O-])=O)S(C(=C\c2cccc(c2)F)\C1=O)(=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.2638 |
logD: | 4.2638 |
logSw: | -4.3434 |
Hydrogen bond acceptors count: | 11 |
Polar surface area: | 85.042 |
InChI Key: | QAZAQTYJSGPEDY-DEOSSOPVSA-N |