4-[[2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ylsulfanyl)acetyl]amino]benzoic acid
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![4-[[2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ylsulfanyl)acetyl]amino]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/4b78518286cf4a9f8aecf30c31a6af15.png "4-[[2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ylsulfanyl)acetyl]amino]benzoic acid")
4-[[2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ylsulfanyl)acetyl]amino]benzoic acid
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CAS No:
304863-59-0
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Formula:
C17H12N4O3S2
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Chemical Name:
4-[[2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ylsulfanyl)acetyl]amino]benzoic acid
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Synonyms:
304863-59-0;4-(2-{7-thia-2,4,5-triazatricyclo[6.4.0.0^{2,6}]dodeca-1(8),3,5,9,11-pentaen-3-ylsulfanyl}acetamido)benzoic acid;4-(2-{7-thia-2,4,5-triazatricyclo[6.4.0.0,2,6]dodeca-1(12),3,5,8,10-pentaen-3-ylsulfanyl}acetamido)benzoic acid;ZINC3319145;AKOS033737700;MCULE-6392071490;NE59434;4-[[2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ylsulfanyl)acetyl]amino]benzoic acid;EN300-05626;SR-01000044071;SR-01000044071-1;Z20237995;4-[2-(Benzo[4,5]thiazolo[2,3-c]-1,2,4-triazol-3-ylthio)acetylamino]benzoic acid;4-(2-{7-thia-2,4,5-triazatricyclo[6.4.0.0?,?]dodeca-1(12),3,5,8,10-pentaen-3-ylsulfanyl}acetamido)benzoic acid
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CAS No:
4-[[2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ylsulfanyl)acetyl]amino]benzoic acid Basic Attributes
384.4 g/mol
384.03508260 g/mol
Computed Properties
Molecular Weight:384.4
XLogP3:4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:384.03508260
Monoisotopic Mass:384.03508260
Topological Polar Surface Area:150
Heavy Atom Count:26
Complexity:544
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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