3-((3R)-3-(4-Amino-3-(4-phenoxyphenyl)-1H-pyrazolo(3,4-d)pyrimidin-1-yl)piperidin-1-yl)-1-((3R)-3-(4-imino-3-(4-phenoxyphenyl)-1H,2H ,4H-pyrazolo(3,4-d)pyrimidin-1-yl)piperidin-1-yl)propan-1-one

cas: 1987905-93-0 — see every product listed under this CAS number, including other names

3-((3R)-3-(4-Amino-3-(4-phenoxyphenyl)-1H-pyrazolo(3,4-d)pyrimidin-1-yl)piperidin-1-yl)-1-((3R)-3-(4-imino-3-(4-phenoxyphenyl)-1H,2H ,4H-pyrazolo(3,4-d)pyrimidin-1-yl)piperidin-1-yl)propan-1-one (CAS 1987905-93-0) is a chemical reagent available from Chemat. Available pack sizes: 10mg, 5mg, 25mg. Offered by: Biosynth.

brandBiosynth
catalog numberMED90593-10mg
cas1987905-93-0
size10mg
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categoryResearch Chemicals
sub-category 1Sourcing
purityNo data
delivery time3-4 weeks
Structural formula: {0} (CAS {1})

1,3-bis[(3R)-3-[4-amino-3-(4-phenoxyphenyl)pyrazolo[3,4-d]pyrimidin-1-yl]piperidin-1-yl]propan-1-one (CAS 1987905-93-0) is a chemical compound with the molecular formula C47H46N12O3 and a molecular weight of 826.9 g/mol. IUPAC name: 1,3-bis[(3R)-3-[4-amino-3-(4-phenoxyphenyl)pyrazolo[3,4-d]pyrimidin-1-yl]piperidin-1-yl]propan-1-one. InChIKey: YVLRPRSHPNBRSQ-KKLWWLSJSA-N.

Identity
Molecular formulaC47H46N12O3
Molecular weight826.9 g/mol
IUPAC name1,3-bis[(3R)-3-[4-amino-3-(4-phenoxyphenyl)pyrazolo[3,4-d]pyrimidin-1-yl]piperidin-1-yl]propan-1-one
InChIKeyYVLRPRSHPNBRSQ-KKLWWLSJSA-N
SMILESC1C[C@H](CN(C1)CCC(=O)N2CCC[C@H](C2)N3C4=NC=NC(=C4C(=N3)C5=CC=C(C=C5)OC6=CC=CC=C6)N)N7C8=NC=NC(=C8C(=N7)C9=CC=C(C=C9)OC1=CC=CC=C1)N

Computed by PubChem (NCBI)

Synonyms: Ibrutinib impurity 6, Ibrutinib Impurity 18, orb3181465
Related forms of this compound
1-[(3R)-3-[4-amino-3-(4-phenoxyphenyl)pyrazolo[3,4-d]pyrimidin-1-yl]piperidin-1-yl]-3-[(3S)-3-[4-amino-3-(4-phenoxyphenyl)pyrazolo[3,4-d]pyrimidin-1-yl]piperidin-1-yl]propan-1-one C47H46N12O3

Also listed as

Ibrutinib Impurity 20 Chemat Brand CAS 1987905-93-0
Ibrutinib Impurity 6 Chemat Brand CAS 1987905-93-0
Ibrutinib Addition Adduct with (R)-1-(3-(4-Amino-3-(4-phenoxyphenyl)-1H-pyrazolo(3,4-d)pyrimidin-1-yl)piperidin-1-yl), >95% (HPLC) TRC CAS 1987905-93-0
1,3-Bis((R)-3-(4-amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl)piperidin-1-yl)propan-1-one, 98%, 98% Chemat CAS 1987905-93-0
Imatinib impurity 2, 99.12% MedChemExpress CAS 1987905-93-0
1,3-Bis((R)-3-(4-amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl)piperidin-1-yl)propan-1-one  (Ibrutinib Impurity）, 98% Fluorochem CAS 1987905-93-0