(S)-[(2R,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol;dihydrate
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(S)-[(2R,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol;dihydrate
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CAS No:
63717-04-4
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Formula:
C20H28N2O4
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Chemical Name:
(S)-[(2R,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol;dihydrate
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Synonyms:
DTXSID00980131;63717-04-4;6'-Methoxycinchonan-9-ol--water (1/2)
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CAS No:
(S)-[(2R,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol;dihydrate Basic Attributes
360.4 g/mol
360.20490738 g/mol
Computed Properties
Molecular Weight:360.4
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:360.20490738
Monoisotopic Mass:360.20490738
Topological Polar Surface Area:47.6
Heavy Atom Count:26
Complexity:457
Defined Atom Stereocenter Count:3
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes
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