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28279-36-9

28279-36-9 structural image
Product Name: 3-[[2-[2,4-Bis(2-methylbutan-2-yl)phenoxy]acetyl]amino]-N-[4,5-dihydro-4-(4-methoxyphenyl)diazenyl-5-oxo-1-(2,4,6-trichlorophenyl)-4H-pyrazol-3-yl]benzamide
Formula: C41H43Cl3N6O5
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COMPUTED DESCRIPTORS

Molecular Weight 806.2 g/mol
XLogP3 11.4
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 14
Exact Mass 804.236052 g/mol
Monoisotopic Mass 804.236052 g/mol
Topological Polar Surface Area 134 Ų
Heavy Atom Count 55
Formal Charge 0
Complexity 1380
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