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845984-96-5

845984-96-5 structural image
Product Name: 1,3-dimethyl-5-phenyl-6-[4-(piperidin-1-ylmethyl)phenyl]pyrrolo[3,4-d]pyrimidine-2,4-dione
Formula: C26H28N4O2
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COMPUTED DESCRIPTORS

Molecular Weight 428.5 g/mol
XLogP3 3.6
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 4
Exact Mass 428.22122615 g/mol
Monoisotopic Mass 428.22122615 g/mol
Topological Polar Surface Area 48.8 Ų
Heavy Atom Count 32
Formal Charge 0
Complexity 679
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