3-[[2-[[5-(2-hydroxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoic acid
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![3-[[2-[[5-(2-hydroxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/f035581065424bce8d256789c6fd3885.png "3-[[2-[[5-(2-hydroxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoic acid")
3-[[2-[[5-(2-hydroxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoic acid
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CAS No:
835887-10-0
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Formula:
C23H18N4O4S
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Chemical Name:
3-[[2-[[5-(2-hydroxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoic acid
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Synonyms:
3-[({[5-(2-hydroxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]thio}acetyl)amino]benzoic acid;CBKinase1_011500;CBKinase1_023900;MLS000663241;CHEMBL1565748;BDBM91752;CS166;HMS2651E10;ZINC2884771;STK743863;AKOS000418639;CCG-203569;MCULE-1750514077;SMR000301056;BRD-K92052879-001-01-1;3-[({[5-(2-hydroxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoic acid;835887-10-0
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CAS No:
3-[[2-[[5-(2-hydroxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoic acid Basic Attributes
446.5 g/mol
446.10487624 g/mol
Computed Properties
Molecular Weight:446.5
XLogP3:3.7
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:446.10487624
Monoisotopic Mass:446.10487624
Topological Polar Surface Area:143
Heavy Atom Count:32
Complexity:648
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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