Fosaprepitant Dibenzyl Ester

CAS: 265121-01-5

Ref. TR-F727385

Informação sobre produto

• Nome: Fosaprepitant Dibenzyl Ester
• Sinónimos: [3-[[(2R,3S)-2-[(1R)-1-[3,5-bis(Trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)-4-morpholinyl]methyl]-2,5-dihydro-5-oxo-1H-1,2,4-triazol-1-yl]-phosphonic Acid bis(Phenylmethyl) Ester, Dibenzyl Fosaprepitant
• CAS: 265121-01-5

Descrição

Stability Moisture Sensitive
Applications Fosaprepitant Dibenzyl Ester is a reactant in the synthetic preparation of phosphorylated morpholine acetal human neurokinin-1 receptor antagonists as water soluble prodrugs.
References Hale, J., et al.: J. Med. Chem., 43, 1234 (2000);

• Marca: TRC

Propriedades químicas

• Peso molecular: 794.652
• Fórmula: C₃₇H₃₄F₇N₄O₆P
• Cor/forma: White to Light Yellow Solid
• InChI: InChI=1S/C37H34F7N4O6P/c1-24(28-18-29(36(39,40)41)20-30(19-28)37(42,43)44)54-34-33(27-12-14-31(38)15-13-27)47(16-17-51-34)21-32-45-35(49)48(46-32)55(50,52-22-25-8-4-2-5-9-25)53-23-26-10-6-3-7-11-26/h2-15,18-20,24,33-34H,16-17,21-23H2,1H3,(H,45,46,49)/t24-
• Chave InChI: InChIKey=MLAHURIEOZYYPF-NICCLAEBSA-N
• SMILES: C[C@@H](O[C@H]1OCCN(Cc2nc(=O)n(P(=O)(OCc3ccccc3)OCc3ccccc3)[nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1