Desfluoro Fosaprepitant dimeglumine
Desfluoro Fosaprepitant dimeglumine is a structural analog of the neurokinin-1 (NK1) receptor antagonist prodrug, Fosaprepitant, presented as a bis-meglumine salt. This impurity variant features a modification within the parent drug's trifluoromethyl group, likely involving the replacement of one fluorine atom with hydrogen, resulting in a difluoromethyl substituent. The compound retains the core phosphate ester linkage to the morpholine-substituted triazole system. Its formation can occur via specific synthetic side reactions or as a degradation product of Fosaprepitant. It functions as a critical reference standard for the chromatographic identification and quantification of related substances in Fosaprepitant active pharmaceutical ingredient.
On Request🔬 Chemical Identifiers
FC(C=1C=C(C=C(C1)C(F)(F)F)[C@@H](C)O[C@H]1OCCN([C@H]1C1=CC=CC=C1)CC1=NN(C(N1)=O)P(O)(O)=O)(F)F.CNC[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O
InChI=1S/C23H23F6N4O6P.C7H17NO5/c1-13(15-9-16(22(24,25)26)11-17(10-15)23(27,28)29)39-20-19(14-5-3-2-4-6-14)32(7-8-38-20)12-18-30-21(34)33(31-18)40(35,36)37;1-8-2-4(10)6(12)7(13)5(11)3-9/h2-6,9-11,13,19-20H,7-8,12H2,1H3,(H,30,31,34)(H2,35,36,37);4-13H,2-3H2,1H3/t13-,19+,20-;4-,5+,6+,7+/m10/s1
BLKGRNBEVDABEV-CQERGIAGSA-N
Dimeglumine.png)
Dimeglumine.png)
