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1133432-46-8,MFCD28716105
Catalog No.:AA008TDN

1133432-46-8 | GDC-0834 Racemate

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Purity
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1mg
98+%
2 weeks  
$260.00   $182.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA008TDN
Chemical Name:
GDC-0834 Racemate
CAS Number:
1133432-46-8
Molecular Formula:
C33H36N6O3S
Molecular Weight:
596.7423
MDL Number:
MFCD28716105
SMILES:
CN1CCN(C(=O)C1c1ccc(cc1)Nc1nc(cn(c1=O)C)c1cccc(c1C)NC(=O)c1cc2c(s1)CCCC2)C
Properties
Computed Properties
 
Complexity:
1140  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
43  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
6  
Undefined Atom Stereocenter Count:
1  
XLogP3:
4.3  

Downstream Synthesis Route

[1]CurrentPatentAssignee:GILEADSCIENCESINC-US2009/82330,2009,A1Locationinpatent:Page/Pagecolumn29

Literature

Title: A novel reaction mediated by human aldehyde oxidase: amide hydrolysis of GDC-0834.

Journal: Drug metabolism and disposition: the biological fate of chemicals 20150601

Title: Potent and selective Bruton's tyrosine kinase inhibitors: discovery of GDC-0834.

Journal: Bioorganic & medicinal chemistry letters 20150315

Title: Significant species difference in amide hydrolysis of GDC-0834, a novel potent and selective Bruton's tyrosine kinase inhibitor.

Journal: Drug metabolism and disposition: the biological fate of chemicals 20111001

Title: Antiarthritis effect of a novel Bruton's tyrosine kinase (BTK) inhibitor in rat collagen-induced arthritis and mechanism-based pharmacokinetic/pharmacodynamic modeling: relationships between inhibition of BTK phosphorylation and efficacy.

Journal: The Journal of pharmacology and experimental therapeutics 20110701

Title: Liu L, et al. Antiarthritis effect of a novel Bruton's tyrosine kinase (BTK) inhibitor in rat collagen-induced arthritis and mechanism-based pharmacokinetic/pharmacodynamic modeling: relationships between inhibition of BTK phosphorylation and efficacy. J Pharmacol Exp Ther. 2011 Jul;338(1):154-63.

Title: Liu L, et al. Significant species difference in amide hydrolysis of GDC-0834, a novel potent and selective Bruton's tyrosine kinase inhibitor. Drug Metab Dispos. 2011 Oct;39(10):1840-9.

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