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351163-56-9

351163-56-9 structural image
Product Name: 5-(4-methoxyphenyl)-2-[(2-piperazin-1-ylethylamino)methylidene]cyclohexane-1,3-dione
Formula: C20H27N3O3
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COMPUTED DESCRIPTORS

Molecular Weight 357.4 g/mol
XLogP3 0.8
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 6
Exact Mass 357.20524173 g/mol
Monoisotopic Mass 357.20524173 g/mol
Topological Polar Surface Area 74.2 Ų
Heavy Atom Count 26
Formal Charge 0
Complexity 532
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