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754159-68-7

754159-68-7 structural image
Product Name: 3-[(1R)-3-[Bis(1-methylethyl)amino]-1-phenylpropyl]-4-(phenylmethoxy)benzoic acid
Formula: C29H35NO3
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COMPUTED DESCRIPTORS

Molecular Weight 445.6 g/mol
XLogP3 4.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 11
Exact Mass 445.26169398 g/mol
Monoisotopic Mass 445.26169398 g/mol
Topological Polar Surface Area 49.8 Ų
Heavy Atom Count 33
Formal Charge 0
Complexity 557
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes