3-[[(5E)-5-[(2-nitrophenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]methyl]benzoic acid
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![3-[[(5E)-5-[(2-nitrophenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]methyl]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/e7b55722b63840f9bc7378a4f6c84e8a.png "3-[[(5E)-5-[(2-nitrophenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]methyl]benzoic acid")
3-[[(5E)-5-[(2-nitrophenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]methyl]benzoic acid
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CAS No:
497082-22-1
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Formula:
C18H12N2O6S
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Chemical Name:
3-[[(5E)-5-[(2-nitrophenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]methyl]benzoic acid
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Synonyms:
MLS000766632;CHEMBL1492389;HMS2754C07;ZINC2352842;AKOS002229238;SMR000414607;ST50100767;AT-057/40872508;3-({5-[(2-nitrophenyl)methylene]-2,4-dioxo-1,3-thiazolidin-3-yl}methyl)benzoic acid;3-[(5-{2-nitrobenzylidene}-2,4-dioxo-1,3-thiazolidin-3-yl)methyl]benzoic acid;3-{5-[1-(2-Nitro-phenyl)-meth-(E)-ylidene]-2,4-dioxo-thiazolidin-3-ylmethyl}-benzoic acid;497082-22-1
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CAS No:
3-[[(5E)-5-[(2-nitrophenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]methyl]benzoic acid Basic Attributes
384.4 g/mol
384.04160728 g/mol
Computed Properties
Molecular Weight:384.4
XLogP3:3.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:4
Exact Mass:384.04160728
Monoisotopic Mass:384.04160728
Topological Polar Surface Area:146
Heavy Atom Count:27
Complexity:673
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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