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478048-44-1

478048-44-1 structural image
Product Name: 6-ACETYL-2-(3,5-DIMETHYLPHENYL)-1,2,4-TRIAZINE-3,5(2H,4H)-DIONE
Formula: C13H13N3O3
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COMPUTED DESCRIPTORS

Molecular Weight 259.26 g/mol
XLogP3 1.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 2
Exact Mass 259.09569129 g/mol
Monoisotopic Mass 259.09569129 g/mol
Topological Polar Surface Area 78.8 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 448
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