4-[3-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]benzoic acid
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![4-[3-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/46d9af2736bd4760911ceb144f80ab20.png "4-[3-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]benzoic acid")
4-[3-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]benzoic acid
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CAS No:
573935-62-3
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Formula:
C19H14N4O3S
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Chemical Name:
4-[3-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]benzoic acid
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Synonyms:
SMR000145448;MLS000551523;CHEMBL1343072;HMS2183G24;ZINC5796744;STK560861;AKOS005486150;AKOS032384902;MCULE-4141767158;4-[3-Mercapto-5-(5-methyl-3-phenyl-isoxazol-4-yl)-[1,2,4]triazol-4-yl]-benzoic acid;4-[3-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl]benzoic acid;573935-62-3
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CAS No:
4-[3-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]benzoic acid Basic Attributes
378.4 g/mol
378.07866149 g/mol
Computed Properties
Molecular Weight:378.4
XLogP3:3.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:378.07866149
Monoisotopic Mass:378.07866149
Topological Polar Surface Area:123
Heavy Atom Count:27
Complexity:614
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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