CAS 404844-03-7

Benzamide, N-[4-methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]phenyl]-4-(1-piperazinylmethyl)-, methanesulfonate (1:1)

Description:

Benzamide, N-[4-methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]phenyl]-4-(1-piperazinylmethyl)-, methanesulfonate (1:1), with CAS number 404844-03-7, is a complex organic compound characterized by its multi-functional structure, which includes a benzamide core and various substituents that enhance its biological activity. This compound features a piperazine moiety, which is often associated with pharmacological properties, and a pyrimidine ring that may contribute to its interaction with biological targets. The methanesulfonate salt form indicates that it is likely soluble in water, which is advantageous for biological assays and formulations. Its molecular structure suggests potential applications in medicinal chemistry, particularly in the development of therapeutic agents targeting specific pathways. The presence of multiple aromatic rings and heterocycles may also influence its electronic properties and reactivity. Overall, this compound exemplifies the complexity often found in drug-like molecules, combining various functional groups that can modulate its pharmacokinetic and pharmacodynamic profiles.

Formula: C₂₈H₂₉N₇O·CH₄O₃S

InChI: InChI=1S/C28H29N7O.CH4O3S/c1-20-4-9-24(17-26(20)34-28-31-12-10-25(33-28)23-3-2-11-30-18-23)32-27(36)22-7-5-21(6-8-22)19-35-15-13-29-14-16-35;1-5(2,3)4/h2-12,17-18,29H,13-16,19H2,1H3,(H,32,36)(H,31,33,34);1H3,(H,2,3,4)

InChI key: InChIKey=BRTOZFXRYMYSOF-UHFFFAOYSA-N

SMILES: N(C=1N=C(C=CN1)C=2C=CC=NC2)C3=CC(NC(=O)C4=CC=C(CN5CCNCC5)C=C4)=CC=C3C.S(C)(=O)(=O)O

Synonyms:

• Benzamide, N-[4-methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]phenyl]-4-(1-piperazinylmethyl)-, monomethanesulfonate
• CGP 74588
• Benzamide, N-[4-methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]phenyl]-4-(1-piperazinylmethyl)-, methanesulfonate (1:1)

N-Desmethyl imatinib mesylate

CAS: 404844-03-7

Norimatinib mesylate, N-Desmethyl imatinib metabolite, inhibits v-Abl, c-Kit, PDGFR.

Formula: C₂₉H₃₃N₇O₄S

Color and Shape: Solid

Molecular weight: 575.68

Ref: TM-T40504

N-Desmethyl Imatinib Mesylate

CAS: 404844-03-7

Applications N-Desmethyl Imatinib Mesylate is a metabolite of Gleevec, a tyrosine kinase inhibitor which is highly specific for BCR-ABL, the enzyme associated with chronic myelogenous leukemia (CML) and certain forms of acute lymphoblastic leukemia (ALL). It is a COVID19-related research product.
References Schindler, T., et al.: Science, 289, 1938 (2000), Drucker, B.J., et al.: N. Engl. J. Med., 344, 1031 (2001),

Formula: C₂₈H₂₉N₇O·CH₄O₃S

Color and Shape: Neat

Molecular weight: 575.68

Ref: TR-D292345

N-Desmethyl imatinib mesylate

CAS: 404844-03-7

N-Desmethyl imatinib mesylate is an active metabolite of Imatinib Mesylate, a drug used to treat metastatic colorectal cancer. The compound is an inhibitor of the tyrosine kinase activity of the epidermal growth factor receptor (EGFR) and is taken orally. N-Desmethyl imatinib mesylate has been shown to be effective in women with metastatic colorectal cancer, producing a hematologic response in 67% of patients. This compound has also been found to have a longer half-life than Imatinib Mesylate and may be used as a substitute for this drug in women with metastatic colorectal cancer who are unable to take oral medications.

Formula: C₂₉H₃₃N₇O₄S

Purity: Min. 95%

Molecular weight: 575.7 g/mol

Ref: 3D-ERA84403