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945396-55-4

945396-55-4 structural image
Product Name: 2,4-Pyrimidinediamine, N2-(3,5-di-4-morpholinylphenyl)-N4-1H-indazol-4-yl-N4-methyl-
Formula: C26H30N8O2
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COMPUTED DESCRIPTORS

Molecular Weight 494.6 g/mol
XLogP3 2.4
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 10
Rotatable Bond Count 6
Exact Mass 494.31177248 g/mol
Monoisotopic Mass 494.31177248 g/mol
Topological Polar Surface Area 90 Ų
Heavy Atom Count 36
Formal Charge 0
Complexity 665
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 3
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes