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497060-19-2

497060-19-2 structural image
Product Name: METHYL 2-(4,5-DIMETHOXY-2-((6-METHYL(1,2,3,4-TETRAHYDROQUINOLYL))SULFONYL)PHENYL)ACETATE
Formula: C21H25NO6S
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COMPUTED DESCRIPTORS

Molecular Weight 419.5 g/mol
XLogP3 3.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 7
Exact Mass 419.14025869 g/mol
Monoisotopic Mass 419.14025869 g/mol
Topological Polar Surface Area 90.5 Ų
Heavy Atom Count 29
Formal Charge 0
Complexity 663
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes