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714934-72-2

714934-72-2 structural image
Product Name: 6-(2-hydroxyethyl)-2,4-dimethyl-7-(4-nitrophenyl)purino[7,8-a]imidazole-1,3-dione
Formula: C17H16N6O5
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COMPUTED DESCRIPTORS

Molecular Weight 384.3 g/mol
XLogP3 1.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 3
Exact Mass 384.11821763 g/mol
Monoisotopic Mass 384.11821763 g/mol
Topological Polar Surface Area 129 Ų
Heavy Atom Count 28
Formal Charge 0
Complexity 663
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