[(S)-(5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-(6-methoxyquinolin-4-yl)methyl] hydrogen sulfate
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![[(S)-(5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-(6-methoxyquinolin-4-yl)methyl] hydrogen sulfate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/45a6283955fe47a48a79e5e7018d5df0.png "[(S)-(5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-(6-methoxyquinolin-4-yl)methyl] hydrogen sulfate")
[(S)-(5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-(6-methoxyquinolin-4-yl)methyl] hydrogen sulfate
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CAS No:
111320-96-8
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Formula:
C20H24N2O5S
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Chemical Name:
[(S)-(5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-(6-methoxyquinolin-4-yl)methyl] hydrogen sulfate
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Synonyms:
111320-96-8;Quinidine hydrogen sulfate (ester);DTXSID40912113;Cinchonan-9-ol, 6'-methoxy-, hydrogen sulfate (ester), (9S)-;6'-Methoxycinchonan-9-yl hydrogen sulfate
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CAS No:
[(S)-(5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-(6-methoxyquinolin-4-yl)methyl] hydrogen sulfate Basic Attributes
404.5 g/mol
404.14059304 g/mol
Computed Properties
Molecular Weight:404.5
XLogP3:0.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:404.14059304
Monoisotopic Mass:404.14059304
Topological Polar Surface Area:97.3
Heavy Atom Count:28
Complexity:666
Defined Atom Stereocenter Count:1
Undefined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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