Products 1226872-27-0

CAS 1226872-27-0 appears in our catalog under these names: Ibrutinib Impurity 3, Ibrutinib Impurity 34（PCI-45227), BTK-IN-3. Offered by: Chemat Brand, Hubei YoungXin, MedChemExpress. Available pack sizes: on request, 10mg, 25mg, 50mg, 100mg, 200mg, Get quote.

Ibrutinib Impurity 3
Chemat Brand
  • size: on request
  • Variants: 1
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Ibrutinib Impurity 34（PCI-45227)
Hubei YoungXin
  • size: 10mg, 25mg, 50mg, 100mg
  • Variants: 5
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BTK-IN-3
MedChemExpress
  • size: Get quote
  • Variants: 1
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Structural formula: {0} (CAS {1})

1-[3-[4-amino-3-(4-phenoxyphenyl)pyrazolo[3,4-d]pyrimidin-1-yl]piperidin-1-yl]-2,3-dihydroxypropan-1-one (CAS 1226872-27-0) is a chemical compound with the molecular formula C25H26N6O4 and a molecular weight of 474.5 g/mol. IUPAC name: 1-[3-[4-amino-3-(4-phenoxyphenyl)pyrazolo[3,4-d]pyrimidin-1-yl]piperidin-1-yl]-2,3-dihydroxypropan-1-one. InChIKey: NWKPMPRXJGMTKQ-UHFFFAOYSA-N.

Identity
Molecular formulaC25H26N6O4
Molecular weight474.5 g/mol
IUPAC name1-[3-[4-amino-3-(4-phenoxyphenyl)pyrazolo[3,4-d]pyrimidin-1-yl]piperidin-1-yl]-2,3-dihydroxypropan-1-one
InChIKeyNWKPMPRXJGMTKQ-UHFFFAOYSA-N
SMILESC1CC(CN(C1)C(=O)C(CO)O)N2C3=NC=NC(=C3C(=N2)C4=CC=C(C=C4)OC5=CC=CC=C5)N

Computed by PubChem (NCBI)

Synonyms: Ibrutinib Impurity 3, Ibrutinib Dihydrodiol, orb2566760
Related forms of this compound
1-[(3R)-3-[4-amino-3-[4-(2,3,4,5,6-pentadeuteriophenoxy)phenyl]pyrazolo[3,4-d]pyrimidin-1-yl]piperidin-1-yl]-2,3-dihydroxypropan-1-one C25H26N6O4
1-[(3R)-3-[4-amino-3-(4-phenoxyphenyl)pyrazolo[3,4-d]pyrimidin-1-yl]piperidin-1-yl]-2,3-dihydroxypropan-1-one C25H26N6O4