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Home > Encyclopedia > 3-[(5E)-5-[(3,4-dihydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid

3-[(5E)-5-[(3,4-dihydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid

3-[(5E)-5-[(3,4-dihydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid structure

3-[(5E)-5-[(3,4-dihydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid 

structure
  • CAS No:

    306323-54-6

  • Formula:

    C13H11NO5S2

  • Chemical Name:

    3-[(5E)-5-[(3,4-dihydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid

  • Synonyms:

    SCHEMBL12008720;ZINC1800291;STK585020;AKOS002201661;ST50147969;3-[(5E)-5-(3,4-dihydroxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoic acid;3-{5-[(3,4-dihydroxyphenyl)methylene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}prop anoic acid;306323-54-6

3-[(5E)-5-[(3,4-dihydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid Basic Attributes

325.4 g/mol

325.00786480 g/mol

Characteristics

156 Ų

1.7116

Computed Properties

Molecular Weight:325.4
XLogP3:1.8
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:4
Exact Mass:325.00786480
Monoisotopic Mass:325.00786480
Topological Polar Surface Area:156
Heavy Atom Count:21
Complexity:493
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 3-[(5E)-5-[(3,4-dihydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid

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