6-[(5E)-5-[(4-chloro-3-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid
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![6-[(5E)-5-[(4-chloro-3-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/94881b9e7bc74cb8b29e35c8bad0cf29.png "6-[(5E)-5-[(4-chloro-3-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid")
6-[(5E)-5-[(4-chloro-3-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid
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CAS No:
307538-99-4
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Formula:
C16H15ClN2O5S2
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Chemical Name:
6-[(5E)-5-[(4-chloro-3-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid
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Synonyms:
ZINC1766425;AKOS030513842;307538-99-4
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CAS No:
6-[(5E)-5-[(4-chloro-3-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid Basic Attributes
414.9 g/mol
414.0110916 g/mol
Computed Properties
Molecular Weight:414.9
XLogP3:4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:414.0110916
Monoisotopic Mass:414.0110916
Topological Polar Surface Area:161
Heavy Atom Count:26
Complexity:622
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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