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Imatinib-[d3]

General Information
Catalog: BLP-005862
CAS: 1144803-18-1
Molecular Formula: C29H28D3N7O
Molecular Weight: 496.63
Chemical Structure
Imatinib-[d3]
Description Imatinib-[d3] is an isotopically labelled analogue of Imatinib, a treatment of chronic myeloid leukemia. It is a COVID-19-related research product.
Synonyms Imatinib-d3 (N-methyl-d3); Genfatinib-d3; 4-[[4-(methyl-d3)-1-piperazinyl]methyl]-N-[4-methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]phenyl]benzamide
IUPAC Name N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]-4-[[4-(trideuteriomethyl)piperazin-1-yl]methyl]benzamide
Related CAS 152459-95-5 (unlabelled)
Canonical SMILES CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)CN3CCN(CC3)C)NC4=NC=CC(=N4)C5=CN=CC=C5
InChI InChI=1S/C29H31N7O/c1-21-5-10-25(18-27(21)34-29-31-13-11-26(33-29)24-4-3-12-30-19-24)32-28(37)23-8-6-22(7-9-23)20-36-16-14-35(2)15-17-36/h3-13,18-19H,14-17,20H2,1-2H3,(H,32,37)(H,31,33,34)/i2D3
InChI Key KTUFNOKKBVMGRW-BMSJAHLVSA-N
Melting Point >195°C (dec.)
Purity 98% by CP; 99% atom D
Solubility Slightly soluble in DMSO, Methanol
Appearance White to Pale Yellow Solid
Storage Store at -20°C

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