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893956-53-1

893956-53-1 structural image
Product Name: 6-(4-chlorophenyl)-2-(3-hydroxypropyl)-4-methyl-7,8-dihydropurino[7,8-a]imidazole-1,3-dione
Formula: C17H18ClN5O3
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COMPUTED DESCRIPTORS

Molecular Weight 375.8 g/mol
XLogP3 1.6
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 4
Exact Mass 375.1098171 g/mol
Monoisotopic Mass 375.1098171 g/mol
Topological Polar Surface Area 81.9 Ų
Heavy Atom Count 26
Formal Charge 0
Complexity 571
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