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852160-37-3

852160-37-3 structural image
Product Name: (S)-methyl 3-methyl-2-((2'-(2-trityl-2H-tetrazol-5-yl)biphenyl-4-yl)methylamino)butanoate
Formula: C39H38BrN5O2
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COMPUTED DESCRIPTORS

Molecular Weight 607.7 g/mol
XLogP3 9.6
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 11
Exact Mass 607.29472544 g/mol
Monoisotopic Mass 607.29472544 g/mol
Topological Polar Surface Area 73.1 Ų
Heavy Atom Count 46
Formal Charge 0
Complexity 889
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