Products 1092578-48-7

CAS 1092578-48-7 appears in our catalog under these names: Tofacitinib Impurity 24, Tofacitinib Impurity 49, (3S,4R)-Tofacitinib, >95% (HPLC), (3S,4R)-Tofacitinib, (3S,4R)-Tofacitinib 96%. Offered by: Chemat Brand, TRC, Biosynth, Ambeed, Chemat. Available pack sizes: on request, 10mg, 1mg, 2,5mg, 25mg, 50mg, 100mg, 250mg.

Tofacitinib Impurity 24
Chemat Brand
  • size: on request
  • Variants: 1
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Tofacitinib Impurity 49
Chemat Brand
  • size: on request
  • Variants: 1
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(3S,4R)-Tofacitinib, >95% (HPLC)
TRC
  • size: 10mg, 1mg, 2,5mg
  • Variants: 3
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(3S,4R)-Tofacitinib
Biosynth, MedChemExpress
  • size: 25mg, 50mg, 100mg, 250mg
  • Variants: 9
from 1559.64
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(3S,4R)-Tofacitinib 96%
Ambeed
  • size: 1mg, 5mg, 10mg, 25mg
  • Variants: 7
from 698.56
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(3S,4R)-4-Methyl-3-(methyl-7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)-β-oxo-1-piperidinepropanenitrile, 96%, 96%
Chemat
  • size: 1mg, 5mg, 10mg, 25mg
  • Variants: 7
from 424.40
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3-((3S,4R)-4-Methyl-3-(Methyl(7H-pyrrolo[2,3-d]pyriMidin-4-yl)aMino)piperidin-1-yl)-3-oxopropanenitrile, 96%
Fluorochem
  • size: 10mg
  • Variants: 1
from 2080.54
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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})

3-[(3S,4R)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile (CAS 1092578-48-7) is a chemical compound with the molecular formula C16H20N6O and a molecular weight of 312.37 g/mol. IUPAC name: 3-[(3S,4R)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile. InChIKey: UJLAWZDWDVHWOW-DGCLKSJQSA-N.

Identity
Molecular formulaC16H20N6O
Molecular weight312.37 g/mol
IUPAC name3-[(3S,4R)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile
InChIKeyUJLAWZDWDVHWOW-DGCLKSJQSA-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, (3S,4R)-, (3S,4R)-Tofacitinib, (3S,4R)-(-)-Tofacitinib isomer, Epitofacitinib, (+/-)-, orb1708148
Related forms of this compound
3-[(3R,4S)-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
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