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33956-01-3

33956-01-3 structural image
Product Name: N-(1-(6-chloro-2,4-xylyl)-5-oxo-2-pyrazolin-3-yl)-2-(3-pentadecylphenoxy)butyramide
Formula: C36H52ClN3O3
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COMPUTED DESCRIPTORS

Molecular Weight 610.3 g/mol
XLogP3 12.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 20
Exact Mass 609.3697202 g/mol
Monoisotopic Mass 609.3697202 g/mol
Topological Polar Surface Area 71 Ų
Heavy Atom Count 43
Formal Charge 0
Complexity 852
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