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477845-38-8

477845-38-8 structural image
Product Name: 2-(3,5-DIMETHYLPHENYL)-4-METHYL-6-(3-[4-(TRIFLUOROMETHOXY)ANILINO]ACRYLOYL)-1,2,4-TRIAZINE-3,5(2H,4H)-DIONE
Formula: C22H19F3N4O4
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COMPUTED DESCRIPTORS

Molecular Weight 460.4 g/mol
XLogP3 5.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 9
Rotatable Bond Count 6
Exact Mass 460.13583959 g/mol
Monoisotopic Mass 460.13583959 g/mol
Topological Polar Surface Area 91.3 Ų
Heavy Atom Count 33
Formal Charge 0
Complexity 811
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes