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887201-43-6

887201-43-6 structural image
Product Name: METHYL 4-[(6,7-DIMETHOXY-1,2,3,4-TETRAHYDROISOQUINOLIN-1-YL)METHOXY]BENZOATE
Formula: C20H23NO5
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility >53.6 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 357.4 g/mol
XLogP3 2.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 7
Exact Mass 357.15762283 g/mol
Monoisotopic Mass 357.15762283 g/mol
Topological Polar Surface Area 66 Ų
Heavy Atom Count 26
Formal Charge 0
Complexity 452
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes