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Application Area
Environmental
Environmental

Stable isotope-labeled compounds are used as environmental pollutant standards for the detection of air, water, soil, sediment and food.

Clinical diagnostic
Clinical diagnostic

In addition to treating various diseases, isotopes are used for imaging, diagnosis, and newborn screening.

Organic Chemistry
Organic Chemistry

Small molecule compounds labeled with stable isotopes can be used as chemical reference for chemical identification, qualitative, quantitative, detection, etc. Various types of NMR solvents can be used to study the structure, reaction mechanism and reaction kinetics of compounds.

Metabolic Research
Metabolic Research

Stable isotope labeling allows researchers to study metabolic pathways in vivo in a safe manner.

Neratinib-[d6]

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General Information
Catalog: BLP-004992
CAS: 1259519-18-0
Molecular Formula: C30H23D6ClN6O3
Molecular Weight: 563.08
Chemical Structure
Neratinib-[d6]
Description Neratinib-[d6] is the labelled analogue of Neratinib, which is an orally available tyrosine kinase receptor inhibitor with potential anti-tumor activity.
Synonyms Neratinib D6; (2E)-N-[4-[[3-Chloro-4-(2-pyridinylmethoxy)phenyl]amino]-3-cyano-7-ethoxy-6-quinolinyl]-4-(dimethylamino-d6)-2-butenamide; HKI 272-d6; Nerlynx-d6
IUPAC Name (E)-4-[bis(trideuteriomethyl)amino]-N-[4-[3-chloro-4-(pyridin-2-ylmethoxy)anilino]-3-cyano-7-ethoxyquinolin-6-yl]but-2-enamide
Related CAS 698387-09-6 (unlabelled)
Canonical SMILES CCOC1=C(C=C2C(=C1)N=CC(=C2NC3=CC(=C(C=C3)OCC4=CC=CC=N4)Cl)C#N)NC(=O)C=CCN(C)C
InChI InChI=1S/C30H29ClN6O3/c1-4-39-28-16-25-23(15-26(28)36-29(38)9-7-13-37(2)3)30(20(17-32)18-34-25)35-21-10-11-27(24(31)14-21)40-19-22-8-5-6-12-33-22/h5-12,14-16,18H,4,13,19H2,1-3H3,(H,34,35)(H,36,38)/b9-7+/i2D3,3D3
InChI Key JWNPDZNEKVCWMY-CJSPGLJTSA-N
Melting Point 97-100°C
Purity ≥96%; ≥99% atom D
Solubility Slightly soluble in DMSO (Heated), Methanol (Heated)
Appearance Light Yellow Solid
Storage Store at 2-8°C
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