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94988-86-0

94988-86-0 structural image
Product Name: 7-AMINO-2,4-DIOXO-5-PHENYL-1,3,5,8-TETRAHYDRO-8-OXAQUINAZOLINE-6-CARBONITRILE
Formula: C14H10N4O3
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COMPUTED DESCRIPTORS

Molecular Weight 282.25 g/mol
XLogP3 0.6
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 1
Exact Mass 282.07529019 g/mol
Monoisotopic Mass 282.07529019 g/mol
Topological Polar Surface Area 117 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 619
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes