Ibrutinib Racemate

cas: 936563-87-0 — see every product listed under this CAS number, including other names

Ibrutinib Racemate (CAS 936563-87-0) is a chemical reagent available from Chemat. Available pack sizes: 100mg, 50mg. Offered by: Biosynth.

brandBiosynth
catalog numberLMB56387-100mg
cas936563-87-0
size100mg
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Available pack sizes

brand size price
Biosynth 100mg price on request
Biosynth 50mg price on request

properties

categoryLife Sciences
purityNo data
delivery time3-4 Weeks
Structural formula: {0} (CAS {1})

1-[3-[4-amino-3-(4-phenoxyphenyl)-1-pyrazolo[3,4-d]pyrimidinyl]-1-piperidinyl]-2-propen-1-one is an aromatic ether.

Source: ChEBI

Identity
Molecular formulaC25H24N6O2
Molecular weight440.5 g/mol
IUPAC name1-[3-[4-amino-3-(4-phenoxyphenyl)pyrazolo[3,4-d]pyrimidin-1-yl]piperidin-1-yl]prop-2-en-1-one
InChIKeyXYFPWWZEPKGCCK-UHFFFAOYSA-N
SMILESC=CC(=O)N1CCCC(C1)N2C3=NC=NC(=C3C(=N2)C4=CC=C(C=C4)OC5=CC=CC=C5)N

Computed by PubChem (NCBI)

Synonyms: Ibrutinib Racemate, Ibrutinib (Racemate), XYFPWWZEPKGCCK-UHFFFAOYSA-N, s2680
Related forms of this compound
1-[(3R)-3-[4-amino-3-(4-phenoxyphenyl)pyrazolo[3,4-d]pyrimidin-1-yl]piperidin-1-yl]prop-2-en-1-one C25H24N6O2
1-[(3S)-3-[4-amino-3-(4-phenoxyphenyl)pyrazolo[3,4-d]pyrimidin-1-yl]piperidin-1-yl]prop-2-en-1-one C25H24N6O2
1-[(3R)-3-[4-amino-3-[4-(2,3,4,5,6-pentadeuteriophenoxy)phenyl]pyrazolo[3,4-d]pyrimidin-1-yl]piperidin-1-yl]prop-2-en-1-one C25H24N6O2
Isomers (same molecular formula)
2-[[6-[(3R)-3-aminopiperidin-1-yl]-3-[(2-cyanophenyl)methyl]-2,4-dioxopyrimidin-1-yl]methyl]benzonitrile C25H24N6O2
1-[4-[4-amino-3-(4-phenoxyphenyl)pyrazolo[3,4-d]pyrimidin-1-yl]piperidin-1-yl]prop-2-en-1-one C25H24N6O2
N-(3-tert-butyl-1,2-oxazol-5-yl)-2-[4-[5-(1H-pyrazol-4-yl)benzimidazol-1-yl]phenyl]acetamide C25H24N6O2

Also listed as

PCI–32765 Racemate GLPBio CAS 936563-87-0
Ibrutinib (Racemate), 95.39% MedChemExpress CAS 936563-87-0
Ibrutinib (Racemate) (Standard) MedChemExpress CAS 936563-87-0
PCI-32765 (Racemate) Chemat CAS 936563-87-0