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852168-08-2

852168-08-2 structural image
Product Name: N-(4-butylphenyl)-2-((2,6,8-trimethyl-5,7-dioxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl)thio)acetamide
Formula: C21H25N5O3S
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COMPUTED DESCRIPTORS

Molecular Weight 427.5 g/mol
XLogP3 3.5
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 7
Exact Mass 427.16781085 g/mol
Monoisotopic Mass 427.16781085 g/mol
Topological Polar Surface Area 121 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 640
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