3-[[5-(3,4-dimethoxyphenyl)-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]propanoic acid
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![3-[[5-(3,4-dimethoxyphenyl)-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/2d2d3c64e6d344fba1c7b28d08886f0d.png "3-[[5-(3,4-dimethoxyphenyl)-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]propanoic acid")
3-[[5-(3,4-dimethoxyphenyl)-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]propanoic acid
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CAS No:
868213-44-9
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Formula:
C20H21N3O5S
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Chemical Name:
3-[[5-(3,4-dimethoxyphenyl)-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]propanoic acid
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Synonyms:
3-{[5-(3,4-dimethoxyphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}propanoic acid;868213-44-9;3-[[5-(3,4-dimethoxyphenyl)-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]propanoic Acid;ZINC2710171;STK807783;AKOS002318907;MCULE-2746341906;ST50777242;SR-01000014970;SR-01000014970-1;F1770-0021;3-[5-(3,4-dimethoxyphenyl)-4-(4-methoxyphenyl)-1,2,4-triazol-3-ylthio]propanoi c acid;3-((5-(3,4-dimethoxyphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl)thio)propanoic acid
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CAS No:
3-[[5-(3,4-dimethoxyphenyl)-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]propanoic acid Basic Attributes
415.5 g/mol
415.12019195 g/mol
Computed Properties
Molecular Weight:415.5
XLogP3:3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:9
Exact Mass:415.12019195
Monoisotopic Mass:415.12019195
Topological Polar Surface Area:121
Heavy Atom Count:29
Complexity:520
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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