CAS 571186-91-9

4-[(4-methyl-4-oxido-piperazin-4-ium-1-yl)methyl]-N-[4-methyl-3-[[4-(3-pyridyl)pyrimidin-2-yl]amino]phenyl]benzamide

Description:

The chemical substance known as "4-[(4-methyl-4-oxido-piperazin-4-ium-1-yl)methyl]-N-[4-methyl-3-[[4-(3-pyridyl)pyrimidin-2-yl]amino]phenyl]benzamide" with CAS number 571186-91-9 is a complex organic compound characterized by its multi-functional structure. It features a piperazine moiety, which is a six-membered ring containing two nitrogen atoms, contributing to its potential biological activity. The presence of a pyrimidine ring and a pyridine group suggests that this compound may exhibit interactions with biological targets, possibly as a pharmaceutical agent. The compound's structure includes various functional groups, such as amides and methyl substituents, which can influence its solubility, stability, and reactivity. Additionally, the oxido-piperazin-ium component indicates a quaternary ammonium structure, which may enhance its solubility in polar solvents. Overall, this compound's intricate design suggests potential applications in medicinal chemistry, particularly in the development of targeted therapies or as a lead compound for further drug development.

Formula: C₂₉H₃₁N₇O₂

InChI: InChI=1/C29H31N7O2/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)20-35-14-16-36(2,38)17-15-35/h3-13,18-19H,14-17,20H2,1-2H3,(H,32,37)(H,31,33,34)

SMILES: Cc1ccc(cc1Nc1nccc(c2cccnc2)n1)NC(=O)c1ccc(cc1)CN1CCN(=O)(C)CC1

Synonyms:

• Imatinib (Piperidine)-N-Oxide

1-Methyl-4-(4-((4-methyl-3-((4-(pyridin-3-yl)pyrimidin-2-yl)amino)phenyl)carbamoyl)benzyl)piperazine 1-oxide (Imatinib Impurity)

CAS: 571186-91-9

Formula: C₂₉H₃₁N₇O₂

Purity: 95%

Color and Shape: Solid

Molecular weight: 509.6021

Ref: IN-DA00EF22

Imatinib EP Impurity J (Imatinib Piperazine N4-Oxide)

CAS: 571186-91-9

Formula: C₂₉H₃₁N₇O₂

Color and Shape: Pale Yellow Solid

Molecular weight: 509.61

Ref: 4Z-I-095

Imatinib EP Impurity J

CAS: 571186-91-9

Formula: C₂₉H₃₁N₇O₂

Molecular weight: 509.61

Ref: ST-EA-CP-I5010

1-Methyl-4-(4-((4-methyl-3-((4-(pyridin-3-yl)pyrimidin-2-yl)amino)phenyl)carbamoyl)benzyl)piperazine 1-oxide (Imatinib Impurity)

CAS: 571186-91-9

Purity: 98%

Molecular weight: 509.614

Ref: 10-F988629

Imatinib (Piperazine)-4-oxide

Controlled Product

CAS: 571186-91-9

Impurity Imatinib EP Impurity J
Applications Imatinib (Piperidine)-4-oxide (Imatinib EP Impurity J) is an impurity of Imatinib (Gleevec) (G407000). Imatinib impurity D. It is a COVID19-related research product.
References Dagher, R., et al.: Clin. Cancer Res., 8, 3034 (2002), Chourasia, M., et al.: J. Pharm. Pharm. Sci., 6, 33 (2003), Deininger, M., et al.: J. Clin. Oncol., 21, 1637 (2003), Gschwind, H., et al.: Drug Metab. Dispos., 33, 1503 (2005),

Formula: C₂₉H₃₁N₇O₂

Color and Shape: Light Yellow

Molecular weight: 509.60

Ref: TR-I268000

Imatinib (piperidine)-N-oxide

CAS: 571186-91-9

Imatinib (piperidine)-N-oxide is a by-product of the synthesis process for Imatinib, which is an inhibitor of tyrosine kinases. Imatinib (piperidine)-N-oxide has been shown to have antineoplastic activity in vitro and in vivo. It is structurally related to CGP 71422, a known tyrosine kinase inhibitor.

Formula: C₂₉H₃₁N₇O₂

Purity: Min. 95%

Molecular weight: 509.6 g/mol

Ref: 3D-FI24543