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477889-18-2

477889-18-2 structural image
Product Name: (E)-3-(4-[(4-Bromobenzyl)oxy]phenyl)-1-[4-(2-methoxyphenyl)piperazino]-2-propen-1-one
Formula: C27H27BrN2O3
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COMPUTED DESCRIPTORS

Molecular Weight 507.4 g/mol
XLogP3 5.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 7
Exact Mass 506.12051 g/mol
Monoisotopic Mass 506.12051 g/mol
Topological Polar Surface Area 42 Ų
Heavy Atom Count 33
Formal Charge 0
Complexity 621
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes