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1164479-53-1

1164479-53-1 structural image
Product Name: tert-butyl ((1S,2R)-1-(5-((2,5-dimethylbenzyl)sulfonyl)-1,3,4-oxadiazol-2-yl)-2-methylbutyl)carbamate
Formula: C21H31N3O5S
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COMPUTED DESCRIPTORS

Molecular Weight 437.6 g/mol
XLogP3 3.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 9
Exact Mass 437.19844227 g/mol
Monoisotopic Mass 437.19844227 g/mol
Topological Polar Surface Area 120 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 673
Isotope Atom Count 0
Defined Atom Stereocenter Count 2
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes