CGI1746

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WARNING: This product is for research use only, not for human or veterinary use.

Description:CGI1746 is a small-molecule Btk inhibitor chemotype with a new binding mode that stabilizes an inactive nonphosphorylated enzyme conformation. CGI1746 has exquisite selectivity for Btk and inhibits both auto- and transphosphorylation steps necessary for enzyme activation.

Price and Availability

CGI1746, purity > 98%, is in stock. The same day shipping out after order is received.

Chemical Structure

Theoretical Analysis

MedKoo Cat#: 406102Name: CGI1746CAS#: 910232-84-7Chemical Formula: C34H37N5O4Exact Mass: 579.28455Molecular Weight: 579.69Elemental Analysis: C, 70.45; H, 6.43; N, 12.08; O, 11.04

Synonym:CGI1746; CGI-1746; CGI 1746.

IUPAC/Chemical Name:4-(tert-butyl)-N-(2-methyl-3-(4-methyl-6-((4-(morpholine-4-carbonyl)phenyl)amino)-5-oxo-4,5-dihydropyrazin-2-yl)phenyl)benzamide

InChi Key:JIFCFQDXHMUPGP-UHFFFAOYSA-N

InChi Code:InChI=1S/C34H37N5O4/c1-22-27(7-6-8-28(22)37-31(40)23-9-13-25(14-10-23)34(2,3)4)29-21-38(5)33(42)30(36-29)35-26-15-11-24(12-16-26)32(41)39-17-19-43-20-18-39/h6-16,21H,17-20H2,1-5H3,(H,35,36)(H,37,40)

SMILES Code:O=C(NC1=CC=CC(C(N=C2NC3=CC=C(C(N4CCOCC4)=O)C=C3)=CN(C)C2=O)=C1C)C5=CC=C(C(C)(C)C)C=C5

Technical Data

Additional Information

References

1: Di Paolo JA, Huang T, Balazs M, Barbosa J, BarckKH, Bravo BJ, Carano RA, Darrow J, Davies DR, DeForge LE, Diehl L,Ferrando R, Gallion SL, Giannetti AM, Gribling P, Hurez V, Hymowitz SG,Jones R, Kropf JE, Lee WP, Maciejewski PM, Mitchell SA, Rong H, StakerBL, Whitney JA, Yeh S, Young WB, Yu C, Zhang J, Reif  K, Currie KS.Specific Btk inhibition suppresses B cell- and myeloid cell-mediatedarthritis. Nat Chem Biol. 2011 Jan;7(1):41-50. doi:10.1038/nchembio.481. Epub 2010 Nov 28. PubMed PMID: 21113169.