(1R,2S,5S)-3-((S)-2-(3-(1-(tert-butylsulfonylmethyl)cyclohexyl)ureido)-3,3-dimethylbutanoyl)-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxylic acid

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Names

[ CAS No. ]:
1229337-32-9

[ Name ]:
(1R,2S,5S)-3-((S)-2-(3-(1-(tert-butylsulfonylmethyl)cyclohexyl)ureido)-3,3-dimethylbutanoyl)-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxylic acid

Chemical & Physical Properties

[ Molecular Formula ]:
C26H45N3O6S

[ Molecular Weight ]:
527.71700

[ Exact Mass ]:
527.30300

[ PSA ]:
144.75000

[ LogP ]:
4.79810

Synthetic Route

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Precursor & DownStream

Precursor

  • Methyl cyclohexanoate
  • cyclohexylidenemethoxymethoxy(trimethyl)silane
  • Cyclohexanone
  • tert-butyl methyl sulfide
  • 2-methyl-2-methylsulfonyl-propane
  • N-cyclohexylidene-2-methylpropane-2-sulfinamide
  • 1-((tert-butylsulfonyl)methyl)cyclohexane-1-carboxylic acid
  • 1-((tert-butylsulfonyl)methyl)-1-isocyanatocyclohexane
  • (S)-2-(3-(1-(tert-butylsulfonylmethyl)cyclohexyl)ureido)-3,3-dimethylbutanoic acid

DownStream

  • (1R,2S,5S)-3-[(2S)-2-[[1-(tert-butylsulfonylmethyl)cyclohexyl]carbamoylamino]-3,3-dimethylbutanoyl]-N-[(3S)-1-(cyclopropylamino)-2-hydroxy-1-oxoheptan-3-yl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide
  • Narlaprevir