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946594-92-9

946594-92-9 structural image
Product Name: Pyrido[3,2-d]pyrimidin-4(3H)-one, 6-(trifluoromethyl)-
Formula: C8H4F3N3O
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COMPUTED DESCRIPTORS

Molecular Weight 215.13 g/mol
XLogP3 0.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 0
Exact Mass 215.03064625 g/mol
Monoisotopic Mass 215.03064625 g/mol
Topological Polar Surface Area 54.4 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 302
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