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53411-33-9

53411-33-9 structural image
Product Name: 1-(2,4,6-Trichlorophenyl)-3-(5-amino-2-chloroanilino)-5-pyrazolone
Formula: C15H10Cl4N4O
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COMPUTED DESCRIPTORS

Molecular Weight 404.1 g/mol
XLogP3 4.4
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 2
Exact Mass 403.957922 g/mol
Monoisotopic Mass 401.960872 g/mol
Topological Polar Surface Area 70.7 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 508
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