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Boceprevir

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Boceprevir / CAS : 394730-60-0

Appearance White or off white crystalline powder UN -
HS 29420000 DG Class -
Synonyms Boceprevir Metabolites; Victrelis; [14C]-Boceprevir; Bocepravir; (1R,2S,5S)-N-(4-Amino-1-Cyclobutyl-3,4-Dioxobutan-2-yl)-3-((S)-2-(3-(tert-Butyl)Ureido)-3,3-Dimethylbutanoyl)-6,6-Dimethyl-3-Azabicyclo[3.1.0]Hexane-2-Carboxamide; 3-{[(1R,2S,5S)-3-[(2S)-2-[(tert-Butylcarbamoyl)Amino]-3,3-Dimethylbutanoyl]-6,6-Dimethyl-3-Azabicyclo[3.1.0]Hexan-2-yl]Formamido}-4-Cyclobutyl-2-Oxobutanamide
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Properties

Summary

Formula
C27H45N5O5
Molecular Mass
519.67700
Exact Mass
519.34200
PSA
150.70000
Logp
3.52210
IUPAC
(1R,2S,5S)-N-(4-amino-1-cyclobutyl-3,4-dioxobutan-2-yl)-3-[(2S)-2-(tert-butylcarbamoylamino)-3,3-dimethylbutanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide
SMILES
CC1(C2C1C(N(C2)C(=O)C(C(C)(C)C)NC(=O)NC(C)(C)C)C(=O)NC(CC3CCC3)C(=O)C(=O)N)C

Attribute classification

Matter Classification
organic
Category
API & Intermediate > Synthetic Anti Infective Drugs

Chemical and Physical Properties

Density
1.162g/cm3
Appearance
White or off white crystalline powder

Export information

HS Code
29420000
Export Rebate
13%

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