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

Modify Date: 2025-08-25 18:44:23

(1R,2S,5S)-3-((S)-2-(3-tert-butylureido)-3,3-dimethylbutanoyl)-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxylic acid structure	Common Name	(1R,2S,5S)-3-((S)-2-(3-tert-butylureido)-3,3-dimethylbutanoyl)-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxylic acid
	CAS Number	816444-90-3	Molecular Weight	367.48300
	Density	N/A	Boiling Point	N/A
	Molecular Formula	C₁₉H₃₃N₃O₄	Melting Point	N/A
	MSDS	N/A	Flash Point	N/A

Name	(1R,2S,5S)-3-((S)-2-(3-tert-butylureido)-3,3-dimethylbutanoyl)-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxylic acid
Synonym	More Synonyms

Molecular Formula	C₁₉H₃₃N₃O₄
Molecular Weight	367.48300
Exact Mass	367.24700
PSA	98.74000
LogP	2.78610
InChIKey	ODCGBMOBUUHGRG-ZDEQEGDKSA-N
SMILES	CC(C)(C)NC(=O)NC(C(=O)N1CC2C(C1C(=O)O)C2(C)C)C(C)(C)C

(1R,2S,5S)-N-(4-amino-1-cyclobutyl-3-hydroxy-4-oxobutan-2-yl)-3-((S)-2-(3-tert-butylureido)-3,3-dimethylbutanoyl)-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide structure

(1R,2S,5S)-N-(4...

CAS#:394735-28-5

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

(1R,2S,5S)-3-((...

CAS#:816444-90-3

Literature: SCHERING CORPORATION Patent: WO2006/130553 A2, 2006 ; Location in patent: Page/Page column 403 ;

Precursor 1
CAS#:394735-28-5 (1R,2S,5S)-N-(4...
DownStream 2
CAS#:394730-60-0 Boceprevir CAS#:3651-67-0 Morpholine, 4-m...

Boceprevir Metabolite M4

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