4-[[2-[[4-(3,4-dimethoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoic acid
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![4-[[2-[[4-(3,4-dimethoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/12aa47ebaed046c4a2f69d10cf460b53.png "4-[[2-[[4-(3,4-dimethoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoic acid")
4-[[2-[[4-(3,4-dimethoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoic acid
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CAS No:
731793-16-1
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Formula:
C25H22N4O5S
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Chemical Name:
4-[[2-[[4-(3,4-dimethoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoic acid
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Synonyms:
MLS001172391;CHEMBL1718362;HMS2882B08;ZINC3277402;AKOS033449372;MCULE-1845141862;SMR000589024;AB00717940-01;Z15904334;4-(2-{[4-(3,4-dimethoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamido)benzoic acid;731793-16-1
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CAS No:
4-[[2-[[4-(3,4-dimethoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoic acid Basic Attributes
490.5 g/mol
490.13109099 g/mol
Computed Properties
Molecular Weight:490.5
XLogP3:4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:9
Exact Mass:490.13109099
Monoisotopic Mass:490.13109099
Topological Polar Surface Area:141
Heavy Atom Count:35
Complexity:701
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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