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88308-22-9

88308-22-9 structural image
Product Name: Propafenone Related Compound B ((2E)-1-[2-[(2RS)-2-hydroxy-3-(propylamino)propoxy]phenyl]-3-phenylprop-2-en-1-one)
Formula: C21H25NO3
Synonyms: (2E)-1-{2-[(2RS)-2-Hydroxy-3-(propylamino)propoxy]phenyl}-3-phenylprop-2-en-1-one
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COMPUTED DESCRIPTORS

Molecular Weight 339.4 g/mol
XLogP3 3.5
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 10
Exact Mass 339.18344366 g/mol
Monoisotopic Mass 339.18344366 g/mol
Topological Polar Surface Area 58.6 Ų
Heavy Atom Count 25
Formal Charge 0
Complexity 404
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes