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919732-57-3

919732-57-3 structural image
Product Name: 6,7-dimethoxy-1-(4-methoxyphenyl)-N-[3-oxo-3-(propan-2-ylamino)propyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide
Formula: C25H33N3O5
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COMPUTED DESCRIPTORS

Molecular Weight 455.5 g/mol
XLogP3 2.7
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 8
Exact Mass 455.24202116 g/mol
Monoisotopic Mass 455.24202116 g/mol
Topological Polar Surface Area 89.1 Ų
Heavy Atom Count 33
Formal Charge 0
Complexity 638
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