Ibrutinib-d5

Name: Ibrutinib-d5
Brand: Vaqora Chemicals
SKU: VQ-037619

About Ibrutinib-d5

Ibrutinib-d5 is a stable isotope labelled analogue related to Ibrutinib carrying the CAS registry number 1553977-17-5. The compound has the formula C25H24N6O2, corresponding to a molecular weight of 445.5 g/mol. Alternative names: (S)-Ibrutinib-d5.

It is supplied as a solid. Keep the vial tightly closed, protected from light and humidity, at the temperature stated on the Certificate of Analysis. Handle it with standard laboratory precautions and appropriate personal protective equipment.

This isotope-labelled compound is used as an internal standard for LC-MS and LC-MS/MS quantitation of Ibrutinib and related analytes in bioanalytical, pharmacokinetic and impurity studies. It is used across pharmaceutical manufacturing and academic and industrial research.

Vaqora Chemicals supplies Ibrutinib-d5 in 10 mg, 25 mg, 50 mg and 100 mg packs, each shipped with a Certificate of Analysis (COA), and exports worldwide.

Typical applications

LC-MS/MS internal standard
Bioanalytical quantitation
Pharmacokinetic studies

Industries

Related to Ibrutinib

View every impurity, metabolite and intermediate we list for Ibrutinib.

Ibrutinib impurities

Grade guides

Specifications & identifiers

Chemical identifiers
Product name	Ibrutinib-d5
Catalogue No.	VQ-037619
CAS Number	1553977-17-5
IUPAC name	1-[(3R)-3-[4-amino-3-[4-(2,3,4,5,6-pentadeuteriophenoxy)phenyl]pyrazolo[3,4-d]pyrimidin-1-yl]piperidin-1-yl]prop-2-en-1-one
Molecular formula	C₂₅H₂₄N₆O₂
Molecular weight	445.5 g/mol
Exact mass	445.2275
Grade	Reference Standard
HSN code	38229090
InChIKey	XYFPWWZEPKGCCK-OZUAZJOXSA-N
SMILES	[2H]C1=C(C(=C(C(=C1[2H])[2H])OC2=CC=C(C=C2)C3=NN(C4=NC=NC(=C34)N)[C@@H]5CCCN(C5)C(=O)C=C)[2H])[2H]
PubChem CID	73053689

Physical properties
Physical form	Solid
LogP (XLogP3)	3.6
H-bond donors / acceptors	1 / 6
TPSA	99.2 Å²

Documents

Safety Data Sheet (SDS)16-section GHS · on request Certificate of AnalysisTypical / batch COA · on request Specification sheetTDS / MOA · on request

Frequently asked questions

What is the CAS number of Ibrutinib-d5?

The CAS Registry Number of Ibrutinib-d5 is 1553977-17-5. It is also known as (S)-Ibrutinib-d5.

What is the molecular formula and molecular weight of Ibrutinib-d5?

Ibrutinib-d5 has the molecular formula C25H24N6O2 and a molecular weight of 445.5 g/mol. Its IUPAC name is 1-[(3R)-3-[4-amino-3-[4-(2,3,4,5,6-pentadeuteriophenoxy)phenyl]pyrazolo[3,4-d]pyrimidin-1-yl]piperidin-1-yl]prop-2-en-1-one.

What is Ibrutinib-d5 used for?

Ibrutinib-d5 is supplied as a characterised reference material related to Ibrutinib. It is used for analytical method development and validation (AMV), impurity profiling, stability studies and quality control, and in ANDA/DMF regulatory filings.

Which grade and pack sizes of Ibrutinib-d5 can I order?

We supply Ibrutinib-d5 in Reference Standard grade, in 10 mg, 25 mg, 50 mg, 100 mg packs. Larger bulk quantities and custom packing are quoted on request.

Do you provide a COA and SDS with Ibrutinib-d5?

Yes. Every lot of Ibrutinib-d5 is shipped with a batch-specific Certificate of Analysis, and a 16-section GHS Safety Data Sheet is provided with the quotation and the shipment.

Can Ibrutinib-d5 be shipped internationally?

Yes. We export Ibrutinib-d5 worldwide by air and sea freight or express courier, on EXW, FOB, CIF, CFR or DAP Incoterms, with full export documentation.