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478247-48-2

478247-48-2 structural image
Product Name: 1-(4-METHYLPHENYL)-6-(METHYLSULFANYL)-1H-PYRAZOLO[3,4-D]PYRIMIDIN-4-YL 2-NAPHTHYL ETHER
Formula: C23H18N4OS
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COMPUTED DESCRIPTORS

Molecular Weight 398.5 g/mol
XLogP3 6.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 4
Exact Mass 398.12013238 g/mol
Monoisotopic Mass 398.12013238 g/mol
Topological Polar Surface Area 78.1 Ų
Heavy Atom Count 29
Formal Charge 0
Complexity 543
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