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333768-54-0

333768-54-0 structural image
Product Name: (3-(2,6-DICHLOROPHENYL)-5-METHYLISOXAZOL-4-YL)-N-(2,3-DIMETHYL-5-OXO-1-PHENYL(3-PYRAZOLIN-4-YL))FORMAMIDE
Formula: C22H18Cl2N4O3
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COMPUTED DESCRIPTORS

Molecular Weight 457.3 g/mol
XLogP3 4.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 4
Exact Mass 456.0755958 g/mol
Monoisotopic Mass 456.0755958 g/mol
Topological Polar Surface Area 78.7 Ų
Heavy Atom Count 31
Formal Charge 0
Complexity 732
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