4-Methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]benzoic acid

CAS: 641569-94-0

Ref. TR-N465305

Product Information

• Name: 4-Methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]benzoic acid
• Synonyms: Benzoic acid, 4-methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]-, Nilotinib Hydrochloride Monohydrate Impurity D, Nilotinib Impurity D, 4-Methyl-3-{[4-(pyridin-3-yl)pyrimidin-2-yl]amino}benzoic acid, Benzoic acid, 4-methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]-, 4-Methyl-3-(4-pyridin-3-yl-pyrimidin-2-ylamino)-benzoic acid, 4-Methyl-3-[(4-(3-Pyridinyl)-Pyrimidinyl)Amino]Benzoic Acid, 4-Methyl-3-[[4-(3-pyridinyl)-2-pyrimidiny]amino]benzoicacid
• CAS: 641569-94-0

Description

Stability Hygroscopic
Applications 4-Methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]benzoic acid is used in the preparation of (pyridinyl)-N-[(triazolyl)phenyl]pyrimidinamine derivatives and (pyridinyl)-N-[oxadiazolyl)phenyl]pyrimidinamine derivatives, and can be used in the detection of their activity as antileukemia agents (neoplastic stem cell leukemia). 4-Methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]benzoic acid is also a Nilotinib (N465300) intermediate, which might be useful in treatment of chronic myelogenous leukemia.
References Li, Y., et al.: Bioorg. Med. Chem. Lett., 26, 1419-1427 (2016)

• Brand: TRC

Chemical properties

• Molecular weight: 306.32
• Formula: C₁₇H₁₄N₄O₂
• Color/Form: Neat
• InChI: InChI=1S/C17H14N4O2/c1-11-4-5-12(16(22)23)9-15(11)21-17-19-8-6-14(20-17)13-3-2-7-18-10-13/h2-10H,1H3,(H,22,23)(H,19,20,21)
• InChI key: InChIKey=LDLZPHLSVKGFSC-UHFFFAOYSA-N
• SMILES: Cc1ccc(C(=O)O)cc1Nc1nccc(-c2cccnc2)n1