Products 1092578-46-5

CAS 1092578-46-5 appears in our catalog under these names: Tofacitinib Impurity 42, Tofacitinib Impurity 28, (3R,4S)-Tofacitinib, >95% (HPLC), (3R,4S)-Tofacitinib, (3R,4S)-Tofacitinib, 99.88%. Offered by: Chemat Brand, TRC, Biosynth, MedChemExpress, Fluorochem. Available pack sizes: on request, 10mg, 1mg, 2,5mg, 5mg, 25mg, 50mg, 5 mg.

Tofacitinib Impurity 42
Chemat Brand
  • size: on request
  • Variants: 1
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Tofacitinib Impurity 28
Chemat Brand
  • size: on request
  • Variants: 1
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(3R,4S)-Tofacitinib, >95% (HPLC)
TRC
  • size: 10mg, 1mg, 2,5mg
  • Variants: 3
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(3R,4S)-Tofacitinib
Biosynth
  • size: 1mg, 5mg, 10mg, 25mg
  • Variants: 5
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(3R,4S)-Tofacitinib, 99.88%
MedChemExpress
  • size: 5 mg, 10 mg
  • Variants: 2
from 1081.31
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3-((3R,4S)-4-Methyl-3-(Methyl(7H-pyrrolo[2,3-d]pyriMidin-4-yl)aMino)piperidin-1-yl)-3-oxopropanenitrile, 98%
Fluorochem
  • size: 10mg, 25mg, 50mg
  • Variants: 3
from 1247.50
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(3R,4S)-4-Methyl-3-(methyl-7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)-β-oxo-1-piperidinepropanenitrile, 98%
Chemat
  • size: 1mg, 5mg, 10mg, 25mg
  • Variants: 5
from 424.40
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Tofacitinib Impurity 20
Chemat Brand
  • size: on request
  • Variants: 1
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Tofacitinib Impurity 26
Hubei YoungXin
  • size: 10mg, 25mg, 50mg, 100mg
  • Variants: 5
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Structural formula: {0} (CAS {1})

(3r,4s)-Tofacitinib is a N-acylpiperidine.

Source: ChEBI

Identity
Molecular formulaC16H20N6O
Molecular weight312.37 g/mol
IUPAC name3-[(3R,4S)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile
InChIKeyUJLAWZDWDVHWOW-AAEUAGOBSA-N
SMILESC[C@H]1CCN(C[C@@H]1N(C)C2=NC=NC3=C2C=CN3)C(=O)CC#N

Computed by PubChem (NCBI)

Synonyms: Epitofacitinib, (3R,4S)-, (3R,4S)-Tofacitinib, (3R,4S)-(+)-Tofacitinib isomer, Tofacitinib Impurity 1, 1092578-46-5(free base), Tofacitinib Impurity O, TRANS-TOFACITINIB
Related forms of this compound
3-[(3S,4R)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile C16H20N6O
3-[(3S,4S)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile C16H20N6O
3-[(3R,4R)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile C16H20N6O
3-[(3R,4S)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile C16H20N6O
3-[4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile C16H20N6O
3-[(3R,4R)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile C16H20N6O
Isomers (same molecular formula)
2-cyano-N-methyl-N-[(3R,4R)-4-methyl-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidin-3-yl]acetamide C16H20N6O
3-[(3R,4R)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-2-yl)amino]piperidin-1-yl]-3-oxopropanenitrile C16H20N6O