4-[[(5Z)-5-[[3-bromo-4-(dimethylamino)phenyl]methylidene]-4-oxo-2-phenylimino-1,3-thiazolidin-3-yl]methyl]benzoic acid
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![4-[[(5Z)-5-[[3-bromo-4-(dimethylamino)phenyl]methylidene]-4-oxo-2-phenylimino-1,3-thiazolidin-3-yl]methyl]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/b7ab1c577bdf48dea0bbb5f7cfeb76eb.png "4-[[(5Z)-5-[[3-bromo-4-(dimethylamino)phenyl]methylidene]-4-oxo-2-phenylimino-1,3-thiazolidin-3-yl]methyl]benzoic acid")
4-[[(5Z)-5-[[3-bromo-4-(dimethylamino)phenyl]methylidene]-4-oxo-2-phenylimino-1,3-thiazolidin-3-yl]methyl]benzoic acid
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CAS No:
444063-13-2
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Formula:
C26H22BrN3O3S
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Chemical Name:
4-[[(5Z)-5-[[3-bromo-4-(dimethylamino)phenyl]methylidene]-4-oxo-2-phenylimino-1,3-thiazolidin-3-yl]methyl]benzoic acid
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Synonyms:
4-{[(2Z,5Z)-5-[3-bromo-4-(dimethylamino)benzylidene]-4-oxo-2-(phenylimino)-1,3-thiazolidin-3-yl]methyl}benzoic acid;AH-487/40935391;STK157192;ZINC58993332;AKOS000328541;ZINC100236226;ZINC252611557;ST50854502;4-(((2Z,5Z)-5-(3-bromo-4-(dimethylamino)benzylidene)-4-oxo-2-(phenylimino)thiazolidin-3-yl)methyl)benzoic acid;4-[(5-{[4-(dimethylamino)-3-bromophenyl]methylene}-4-oxo-2-(phenylazamethylene )-1,3-thiazolidin-3-yl)methyl]benzoic acid;4-{[5-[3-bromo-4-(dimethylamino)benzylidene]-4-oxo-2-(phenylimino)-1,3-thiazolidin-3-yl]methyl}benzoic acid;444063-13-2
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CAS No:
4-[[(5Z)-5-[[3-bromo-4-(dimethylamino)phenyl]methylidene]-4-oxo-2-phenylimino-1,3-thiazolidin-3-yl]methyl]benzoic acid Basic Attributes
536.4 g/mol
535.05653 g/mol
Computed Properties
Molecular Weight:536.4
XLogP3:6.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:535.05653
Monoisotopic Mass:535.05653
Topological Polar Surface Area:98.5
Heavy Atom Count:34
Complexity:803
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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