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1445951-52-9

1445951-52-9 structural image
Product Name: Racemic-(4R,4aS,7aS)-tert-butyl 6-benzyl-4-hydroxyoctahydro-1H-pyrrolo[3,4-b]pyridine-1-carboxylate(WX111498)
Formula: C19H28N2O3
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COMPUTED DESCRIPTORS

Molecular Weight 332.4 g/mol
XLogP3 2.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 4
Exact Mass 332.20999276 g/mol
Monoisotopic Mass 332.20999276 g/mol
Topological Polar Surface Area 53 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 442
Isotope Atom Count 0
Defined Atom Stereocenter Count 3
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes