Ibrutinib Diamide impurity
Impurity
This molecule is a impurity of Ibrutinib.
Technical Data
Cat. No.ANT-IBT-016
CAS2031255-27-1
Mol. FormulaC28H26N6O3
Mol. Weight494.555 g/mol
IUPACN-[3-(4-phenoxyphenyl)-1-[(3R)-1-prop-2-enoylpiperidin-3-yl]pyrazolo[3,4-d]pyrimidin-4-yl]prop-2-enamide
SMILESC=CC(=O)NC1=C2C(=NN(C2=NC=N1)[C@@H]3CCCN(C3)C(=O)C=C)C4=CC=C(C=C4)OC5=CC=CC=C5
InChIInChI=1S/C28H26N6O3/c1-3-23(35)31-27-25-26(19-12-14-22(15-13-19)37-21-10-6-5-7-11-21)32-34(28(25)30-18-29-27)20-9-8-16-33(17-20)24(36)4-2/h3-7,10-15,18,20H,1-2,8-9,16-17H2,(H,29,30,31,35)/t20-/m1/s1
InChI KeyMEPHIAOJXIXZOG-HXUWFJFHSA-N
Description
Overview
Ibrutinib Diamide impurity, Ibrutinib, 2031255-27-1, N-[3-(4-phenoxyphenyl)-1-[(3R)-1-prop-2-enoylpiperidin-3-yl]pyrazolo[3,4-d]pyrimidin-4-yl]prop-2-enamide
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Synonyms
2031255-27-1N6-AcryloylIbrutinibN6-Acryloyl Ibrutinib(R)-N-(1-(1-Acryloylpiperidin-3-yl)-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl)acrylamideN-[3-(4-phenoxyphenyl)-1-[(3R)-1-(prop-2-enoyl)piperidin-3-yl]-1H-pyrazolo[3,4-d]pyrimidin-4-yl]prop-2-enamideSCHEMBL12713449EBC-97054CS-0164736EN300-27162003(R)-N-(1-(1-acryloylpiperidin-3-yl)-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl)acrylamide? (Ibrutinib Impurity pound(c)
