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61354-99-2

61354-99-2 structural image
Product Name: 2-(3-tert-Butyl-4-hydroxyphenoxy)-N-(4-chloro-3-((4,5-dihydro-5-oxo-1-(2,4,6-trichlorophenyl)-1H-pyrazol-3-yl)amino)phenyl)myristamide
Formula: C39H48Cl4N4O4
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COMPUTED DESCRIPTORS

Molecular Weight 778.6 g/mol
XLogP3 13.4
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 18
Exact Mass 778.240017 g/mol
Monoisotopic Mass 776.242967 g/mol
Topological Polar Surface Area 103 Ų
Heavy Atom Count 51
Formal Charge 0
Complexity 1110
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes