Products 2744171-54-6

CAS 2744171-54-6 appears in our catalog under these names: Abrocitinib Impurity 1, Hydroxy Abrocitinib. Offered by: Chemat Brand, TRC. Available pack sizes: on request, 25mg, 5mg.

Abrocitinib Impurity 1
Chemat Brand
  • size: on request
  • Variants: 1
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Hydroxy Abrocitinib
TRC
  • size: 25mg, 5mg
  • Variants: 2
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Structural formula: {0} (CAS {1})

3-hydroxy-N-[3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]cyclobutyl]propane-1-sulfonamide (CAS 2744171-54-6) is a chemical compound with the molecular formula C14H21N5O3S and a molecular weight of 339.42 g/mol. IUPAC name: 3-hydroxy-N-[3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]cyclobutyl]propane-1-sulfonamide. InChIKey: BUCWCFYDDFQXLE-UHFFFAOYSA-N.

Identity
Molecular formulaC14H21N5O3S
Molecular weight339.42 g/mol
IUPAC name3-hydroxy-N-[3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]cyclobutyl]propane-1-sulfonamide
InChIKeyBUCWCFYDDFQXLE-UHFFFAOYSA-N
SMILESCN(C1CC(C1)NS(=O)(=O)CCCO)C2=NC=NC3=C2C=CN3

Computed by PubChem (NCBI)

Synonyms: Abrocitinib metabolite M1, Hydroxy Abrocitinib
Isomers (same molecular formula)
(2S)-2-hydroxy-N-[3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]cyclobutyl]propane-1-sulfonamide C14H21N5O3S
(2R,3R,4S,5S)-2-(6-aminopurin-9-yl)-5-(butan-2-ylsulfanylmethyl)oxolane-3,4-diol C14H21N5O3S