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377064-96-5

377064-96-5 structural image
Product Name: ethyl 2-((1,3-dimethyl-7-(2-methylallyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)thio)acetate
Formula: C15H20N4O4S
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COMPUTED DESCRIPTORS

Molecular Weight 352.4 g/mol
XLogP3 2.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 7
Exact Mass 352.12052631 g/mol
Monoisotopic Mass 352.12052631 g/mol
Topological Polar Surface Area 110 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 556
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