N-2-[(Dimethylamino)methylene]amino Pemetrexed

CAS: 1265908-58-4

Ref. TR-D481335

Informação sobre produto

• Nome: N-2-[(Dimethylamino)methylene]amino Pemetrexed
• Sinónimos: L-Glutamic acid, N-[4-[2-[2-[[(dimethylamino)methylene]amino]-4,7-dihydro-4-oxo-3H-pyrrolo[2,3-d]pyrimidin-5-yl]ethyl]benzoyl]-

Descrição

Applications N-2-[(Dimethylamino)methylene]amino Pemetrexed (Pemetrexed N,N-Dimethyl Form Amide Impurity) is derived from N-[4-[2-(2-Amino-4,7-dihydro-4-oxo-3H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl]benzoyl]-L-glutamic Acid 1,5-Diethyl Ester 4-Methylbenzenesulfonate (A605005), which is used in the preparation of Pemetrexed (A604980) Sodium. Pemetrexed, is used in the treatment of malignant pleural mesothelioma (MPM).
References Pasello, G. et al.: Anticanc. Res., 32, 5393 (2012);

• Marca: TRC

Propriedades químicas

• Peso molecular: 482.489
• Fórmula: C₂₃H₂₆N₆O₆
• Cor/forma: Neat
• InChI: InChI=1S/C23H26N6O6/c1-29(2)12-25-23-27-19-18(21(33)28-23)15(11-24-19)8-5-13-3-6-14(7-4-13)20(32)26-16(22(34)35)9-10-17(30)31/h3-4,6-7,11-12,16H,5,8-10H2,1-2H3,(H,26,32)(H,30,31)(H,34,35)(H2,24,27,28,33)/b25-12-/t16-/m0/s1
• Chave InChI: InChIKey=WTQOMFBCQAJBJV-YEEYNWEUSA-N
• SMILES: CN(C)/C=N/c1nc(=O)c2c(CCc3ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc3)c[nH]c2[nH]1