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477853-96-6

477853-96-6 structural image
Product Name: 4-HYDROXY-6-(2-METHOXYPHENYL)-2-PHENYL-5-PYRIMIDINECARBONITRILE
Formula: C18H13N3O2
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COMPUTED DESCRIPTORS

Molecular Weight 303.3 g/mol
XLogP3 2.5
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 303.100776666 g/mol
Monoisotopic Mass 303.100776666 g/mol
Topological Polar Surface Area 74.5 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 578
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