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872838-61-4

872838-61-4 structural image
Product Name: 2-[(2-chloro-6-fluorophenyl)methyl]-6-(furan-2-ylmethyl)-4-methyl-7,8-dihydropurino[7,8-a]imidazole-1,3-dione
Formula: C20H17ClFN5O3
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COMPUTED DESCRIPTORS

Molecular Weight 429.8 g/mol
XLogP3 2.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 4
Exact Mass 429.1003953 g/mol
Monoisotopic Mass 429.1003953 g/mol
Topological Polar Surface Area 74.8 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 701
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