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865658-25-9

865658-25-9 structural image
Product Name: 2-(CYANOMETHYL)-5-(3-FLUORO-4-METHOXYPHENYL)-6-METHYLPYRAZOLO[1,5-A]PYRIMIDINE-3-CARBONITRILE
Formula: C17H12FN5O
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COMPUTED DESCRIPTORS

Molecular Weight 321.31 g/mol
XLogP3 1.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 3
Exact Mass 321.10258819 g/mol
Monoisotopic Mass 321.10258819 g/mol
Topological Polar Surface Area 87 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 554
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