Pemetrexed-d5 Diethyl Ester

CAS: 146943-43-3

Ref. TR-P219512

Produktinformation

• Name: Pemetrexed-d5 Diethyl Ester
• Synonyme: Diethyl 2-(4-(2-(2-Amino-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl)benzamido)pentanedioate-d5, 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, (s)-diethyl-2-(4-(2-(2-amino-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl)benzamido) pentanedioate

Beschreibung

Applications Isotope labelled Pemetrexed-d5 Diethyl Ester is an protected intermediate in the synthesis of Pemetrexed (P219500), an multitargeted antifolate that inhibits thymidylate synthase as well as other folate dependent enzymes.
References Kjell, D.P., et al.: Org. Proc. Res. Development., 9, 738 (2005); Taylor, E. C., et al.: J. Org. Chem., 66, 3726 (2001);

• Marke: TRC

Chemische Eigenschaften

• Molekulargewicht: 488.548
• Formel: C₂₄D₅H₂₄N₅O₆
• Farbe/Form: Neat
• InChl: InChI=1S/C24H29N5O6/c1-3-34-18(30)12-11-17(23(33)35-4-2)27-21(31)15-8-5-14(6-9-15)7-10-16-13-26-20-19(16)22(32)29-24(25)28-20/h5-6,8-9,13,17H,3-4,7,10-12H2,1-2H3,(H,27,31)(H4,25,26,28,29,32)/t17-/m0/s1/i11D2,12D2,17D
• InChI Key: InChIKey=DEJAOZLLEHXUBF-REEALJHGSA-N
• SMILES: [2H]C([2H])(C(=O)OCC)C([2H])([2H])[C@]([2H])(NC(=O)c1ccc(CCc2c[nH]c3[nH]c(N)nc(=O)c23)cc1)C(=O)OCC