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691846-63-6

691846-63-6 structural image
Product Name: 2-METHYL-BIPHENYL-4,4'-DICARBOXYLIC ACID 4-AMIDE 4'-([4-METHOXY-3-(4-METHYL-PIPERAZIN-1-YL)-PHENYL]-AMIDE)
Formula: C27H30N4O3
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COMPUTED DESCRIPTORS

Molecular Weight 458.6 g/mol
XLogP3 3.5
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 6
Exact Mass 458.23179083 g/mol
Monoisotopic Mass 458.23179083 g/mol
Topological Polar Surface Area 87.9 Ų
Heavy Atom Count 34
Formal Charge 0
Complexity 687
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