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2068022-09-1

2068022-09-1 Structure

2068022-09-1 Structure
IdentificationBack Directory
[Name]

Ibrutinib Impurity 9
[CAS]

2068022-09-1
[Synonyms]

Ibrutinib Impurity 3-d5
N-(1-((S)-1-acryloylpiperidin-3-yl)-
Ibrutinib Impurity 3-d5 (PCI-45227-d5)
Ibrutinib Impurity 3-d5 (PCI-45227-d5)(Mixture of Diastereomers)
1-((R)-3-(4-Amino-3-(4-(phenoxy-d5)phenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl)piperidin-1-yl)-2,3-dihydroxypropan-1-one
1-[(3R)-3-[4-amino-3-[4-(2,3,4,5,6-pentadeuteriophenoxy)phenyl]pyrazolo[3,4-d]pyrimidin-1-yl]piperidin-1-yl]-2,3-dihydroxypropan-1-one
[Molecular Formula]

C25H21D5N6O4
[MOL File]

2068022-09-1.mol
[Molecular Weight]

479.543
Hazard InformationBack Directory
[Uses]

Dihydrodiol-Ibrutinib-d5 is the deuterium labeled Dihydrodiol-Ibrutinib (HY-100659). Dihydrodiol-Ibrutinib is a dihydrodiol active metabolite of Ibrutinib (HY-10997), has inhibitory activity towards BTK approximately 15 times lower than that of ibrutinib[1].
[References]

[1] Sridhar Veeraraghavan,et al. Simultaneous quantification of lenalidomide, ibrutinib and its active metabolite PCI-45227 in rat plasma by LC-MS/MS: application to a pharmacokinetic study. J Pharm Biomed Anal DOI:10.1016/j.jpba.2014.11.041
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