3-[[2-[[9-methyl-2-(4-methylphenyl)-5H-chromeno[2,3-d]pyrimidin-4-yl]sulfanyl]acetyl]amino]benzoic acid
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![3-[[2-[[9-methyl-2-(4-methylphenyl)-5H-chromeno[2,3-d]pyrimidin-4-yl]sulfanyl]acetyl]amino]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/27369aeca35c44d2ba30e04642d0b4a9.png "3-[[2-[[9-methyl-2-(4-methylphenyl)-5H-chromeno[2,3-d]pyrimidin-4-yl]sulfanyl]acetyl]amino]benzoic acid")
3-[[2-[[9-methyl-2-(4-methylphenyl)-5H-chromeno[2,3-d]pyrimidin-4-yl]sulfanyl]acetyl]amino]benzoic acid
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CAS No:
866842-71-9
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Formula:
C28H23N3O4S
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Chemical Name:
3-[[2-[[9-methyl-2-(4-methylphenyl)-5H-chromeno[2,3-d]pyrimidin-4-yl]sulfanyl]acetyl]amino]benzoic acid
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Synonyms:
CHEMBL1592234;UCK2-IN-20874830;3-(2-((9-Methyl-2-(p-tolyl)-5H-chromeno[2,3-d]pyrimidin-4-yl)thio)acetamido)benzoic acid;866842-71-9;HMS1833G18;ZINC2693920;BDBM50522195;MCULE-5072686597;NCGC00111735-01;NCGC00111735-02;NCGC00111735-03;NCGC00111735-04;NCGC00111735-05;NCGC00111735-06;AB00675334-01;C683-0762;3-[({[9-methyl-2-(4-methylphenyl)-5H-chromeno[2,3-d]pyrimidin-4-yl]thio}acetyl)amino]benzoic acid
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CAS No:
3-[[2-[[9-methyl-2-(4-methylphenyl)-5H-chromeno[2,3-d]pyrimidin-4-yl]sulfanyl]acetyl]amino]benzoic acid Basic Attributes
497.6 g/mol
497.14092740 g/mol
Computed Properties
Molecular Weight:497.6
XLogP3:5.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:497.14092740
Monoisotopic Mass:497.14092740
Topological Polar Surface Area:127
Heavy Atom Count:36
Complexity:776
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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