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442673-26-9

442673-26-9 structural image
Product Name: 8-ethyl-6-(3-methoxypropyl)-2,4-dimethyl-7-phenylpurino[7,8-a]imidazole-1,3-dione
Formula: C21H25N5O3
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COMPUTED DESCRIPTORS

Molecular Weight 395.5 g/mol
XLogP3 3.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 6
Exact Mass 395.19573968 g/mol
Monoisotopic Mass 395.19573968 g/mol
Topological Polar Surface Area 72.1 Ų
Heavy Atom Count 29
Formal Charge 0
Complexity 625
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