Tofacitinib Impurity 62 Citrate
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Includes: HPLC, MASS/LC-MS, 1H NMR, FT-IR, Potency, Structure Elucidation Report (SER), and additional analytical data depending on the product.

1092578-47-6Tofacitinib Impurity 62 Citrate

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Catalogue No.:VE008307
CAS No.:1092578-47-6
Mol. Formula:C16H20N6O
Mol. Weight:312.37 g/mol

Additional information on CAS 1092578-47-6

Parent drug

Tofacitinib

IUPAC Name

(3S,4S)-4-Methyl-3-(methyl-7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)-β-oxo-1-piperidinepropanenitrile

Synonyms

Tofacitinib (3S, 4S)-Isomer

Description

(3S,4S)-Tofacitinib, CAS 1092578-47-6, is a stereoisomeric impurity related to the JAK inhibitor tofacitinib and should be regarded as a process- or stereochemical impurity rather than a distinct pharmacophore. With molecular formula C16H20N6O and molecular weight 312.37 g/mol, it differs from the intended active substance only in absolute configuration at the 3 and 4 positions of the piperidine-derived framework. Such epimeric or diastereomeric species may arise from asymmetric synthesis drift, chiral pool misassignment, or racemization during late-stage transformations. Quantification generally requires chiral LC-MS/MS or enantioselective LC-UV, with orthogonal NMR confirmation when structural assignment is required.

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