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898915-11-2

898915-11-2 structural image
Product Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-2-ethyl-10-methylpyrimido[4,5-b]quinoline-4,5-dione
Formula: C24H25N3O4
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COMPUTED DESCRIPTORS

Molecular Weight 419.5 g/mol
XLogP3 3.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 6
Exact Mass 419.18450629 g/mol
Monoisotopic Mass 419.18450629 g/mol
Topological Polar Surface Area 71.4 Ų
Heavy Atom Count 31
Formal Charge 0
Complexity 777
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