Ceritinib-d7

CAS: 1632484-77-5

Ref. TR-C367367

Produktinformation

• Name: Ceritinib-d7
• Synonyme: 5-Chloro-N4-[2-[(1-methylethyl)sulfonyl]phenyl]-N2-[5-methyl-2-[1-(methyl-d3)ethoxy-1,2,2,2-d4]-4-(4-piperidinyl)phenyl]-2,4-pyrimidinediamine
• Marke: TRC
• Beschreibung: Applications Ceritinib-d7 is derived from 2-Chloro-4-fluoro-5-nitrotoluene (C366770), which is used as a reagent in the synthesis of potent and selective anaplastic lymphoma kinase (ALK-5) inhibitors, used as an anti-tumor treatment. Also used in the synthesis of herbicides; Deuterium labelled analog of the drug Ceritinib (C367365).References Marsilje, T. et al.: J. Med. Chem., 56, 5675 (2013); Theodoridis, G. et al.: Pest. Sci., 30, 259 (1990); Marsilje, T. H., et al.: J. Med. Chem., 56, 5675 (2013)

Chemische Eigenschaften

• Molekulargewicht: 565.178
• Formel: C₂₈D₇H₂₉ClN₅O₃S
• Farbe/Form: Neat
• InChl: InChI=1S/C28H36ClN5O3S/c1-17(2)37-25-15-21(20-10-12-30-13-11-20)19(5)14-24(25)33-28-31-16-22(29)27(34-28)32-23-8-6-7-9-26(23)38(35,36)18(3)4/h6-9,14-18,20,30H,10-13H2,1-5H3,(H2,31,32,33,34)/i1D3,2D3,17D
• InChI Key: InChIKey=VERWOWGGCGHDQE-WFBMWZOZSA-N
• SMILES: [2H]C([2H])([2H])C([2H])(Oc1cc(C2CCNCC2)c(C)cc1Nc1ncc(Cl)c(Nc2ccccc2S(=O)(=O)C(C)C)n1)C([2H])([2H])[2H]