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839706-07-9

839706-07-9 structural image
Product Name: BenzaMide, N-[3-[1,4-dihydro-1-Methyl-7-[(6-Methyl-3-pyridinyl)aMino]-2-oxopyriMido[4,5-d]pyriMidin-3(2H)-yl]-4-Methylphenyl]-3-(trifluoroMethyl)-
Formula: C28H24F3N7O2
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COMPUTED DESCRIPTORS

Molecular Weight 547.5 g/mol
XLogP3 4.3
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 9
Rotatable Bond Count 5
Exact Mass 547.19435752 g/mol
Monoisotopic Mass 547.19435752 g/mol
Topological Polar Surface Area 103 Ų
Heavy Atom Count 40
Formal Charge 0
Complexity 908
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