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919749-55-6

919749-55-6 structural image
Product Name: N-(3-anilino-3-oxopropyl)-6,7-dimethoxy-1-(4-methoxyphenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide
Formula: C28H31N3O5
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COMPUTED DESCRIPTORS

Molecular Weight 489.6 g/mol
XLogP3 3.5
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 8
Exact Mass 489.22637110 g/mol
Monoisotopic Mass 489.22637110 g/mol
Topological Polar Surface Area 89.1 Ų
Heavy Atom Count 36
Formal Charge 0
Complexity 707
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