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Product Overview

Product Code

TRC-D291890

CAS Number

1365802-18-1

Product Format

Neat

Molecular Formula

C52 H48 N12 O2

Molecular Weight

873.02

API Family

Imatinib

Product Categories

TRC, Impurity Reference Materials , Kinase Inhibitors

Product Type

Impurity

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Product Information

Chemical Data

Analyte Name

4,4'-[1,4-Piperazinediylbis(methylene)]bis[N-[4-methyl-3-[(4-(3-pyridinyl)-2-pyrimidinyl)amino]phenyl]benzamide]

CAS Number

1365802-18-1

Molecular Formula

C52 H48 N12 O2

Molecular Weight

873.02

Accurate Mass

872.4023

SMILES

Cc1ccc(NC(=O)c2ccc(CN3CCN(Cc4ccc(cc4)C(=O)Nc5ccc(C)c(Nc6nccc(n6)c7cccnc7)c5)CC3)cc2)cc1Nc8nccc(n8)c9cccnc9

InChI

InChI=1S/C52H48N12O2/c1-35-7-17-43(29-47(35)61-51-55-23-19-45(59-51)41-5-3-21-53-31-41)57-49(65)39-13-9-37(10-14-39)33-63-25-27-64(28-26-63)34-38-11-15-40(16-12-38)50(66)58-44-18-8-36(2)48(30-44)62-52-56-24-20-46(60-52)42-6-4-22-54-32-42/h3-24,29-32H,25-28,33-34H2,1-2H3,(H,57,65)(H,58,66)(H,55,59,61)(H,56,60,62)

IUPAC

N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]-4-[[4-[[4-[[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]carbamoyl]phenyl]methyl]piperazin-1-yl]methyl]benzamide

Product Data

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Impurity

Product Format

Neat

API Family

Imatinib

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Des(methylpiperazinyl-N-methyl) Imatinib Dimer Impurity

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