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77917-22-7

77917-22-7 structural image
Product Name: 2,3-Piperazinedione, 1-((4-nitrophenyl)methyl)-4-((4-(2-pyrimidinylami no)phenyl)methyl)-
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COMPUTED DESCRIPTORS

Molecular Weight 432.4 g/mol
XLogP3 2.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 6
Exact Mass 432.15460314 g/mol
Monoisotopic Mass 432.15460314 g/mol
Topological Polar Surface Area 124 Ų
Heavy Atom Count 32
Formal Charge 0
Complexity 664
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