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Entrectinib(RXDX-101) Catalog No : 100504

Chemical Information

Product NameEntrectinib(RXDX-101)
Iupac Chemical NameN-(5-(3,5-difluorobenzyl)-1H-indazol-3-yl)-4-(4-methylpiperazin-1-yl)-2-((tetrahydro-2H-pyran-4-yl)amino)benzamide 
SynonymsRXDX-101;RXDX 101;RXDX101;Entrectinib;NMS-E628
Molecular FormulaC31H34F2N6O2 
Molecular Weight560.64 
SmileO=C(NC1=NNC2=C1C=C(CC3=CC(F)=CC(F)=C3)C=C2)C4=CC=C(N5CCN(C)CC5)C=C4NC6CCOCC6
InChiKeyHAYYBYPASCDWEQ-UHFFFAOYSA-N
InChiInChI=1S/C31H34F2N6O2/c1-38-8-10-39(11-9-38)25-3-4-26(29(19-25)34-24-6-12-41-13-7-24)31(40)35-30-27-17-20(2-5-28(27)36-37-30)14-21-15-22(32)18-23(33)16-21/h2-5,15-19,24,34H,6-14H2,1H3,(H2,35,36,37,40)
Cas1108743-60-7

Technical Data

Appearanceoff-white solid 
Purity98% by HPLC 
SolubilitySoluble in DMSO to 20 mM 
Storage3 years -20ºCpowder 6 months-80ºCin solvent 
Shipping ConditionShipped under ambient temperature 
Quality control HNMR

Description

Entrectinib (RXDX-101) is a selective inhibitor for all three TRK receptor tyrosine kinases encoded by the three NTRK genes, as well as the ROS1 and ALK receptor tyrosine kinases.

Chemical Structure

100504 - Entrectinib(RXDX-101) | CAS 1108743-60-7

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