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951981-14-9

951981-14-9 structural image
Product Name: 4-(tert-butyl)-N-((4-hydroxy-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl)methyl)benzamide
Formula: C23H23N5O2
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COMPUTED DESCRIPTORS

Molecular Weight 401.5 g/mol
XLogP3 3.7
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 5
Exact Mass 401.18517499 g/mol
Monoisotopic Mass 401.18517499 g/mol
Topological Polar Surface Area 88.4 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 672
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