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956181-20-7

956181-20-7 structural image
Product Name: (S)-3,4-dimethyl-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)-4-(methylthio)butanoate
Formula: C24H25NO6S
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COMPUTED DESCRIPTORS

Molecular Weight 455.5 g/mol
XLogP3 4.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 10
Exact Mass 455.14025869 g/mol
Monoisotopic Mass 455.14025869 g/mol
Topological Polar Surface Area 116 Ų
Heavy Atom Count 32
Formal Charge 0
Complexity 717
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