New
Ibrutinib
Standard
CAS#[936563-96-1]
G-codeGEO-04903
Molecular formulaC25H24N6O2
Molecular weight440.5
Synonyms 1-[(3R)-3-[4-amino-3-(4-phenoxyphenyl)pyrazolo[3,4-d]pyrimidin-1-yl]piperidin-1-yl]prop-2-en-1-one ; 1-[(3R)-3-[4-amino-3-(4-phenoxyphenyl)pyrazolo[3,4-d]pyrimidin-1-yl]piperidino]prop-2-en-1-one
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Pack Sizes & Pricing
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Structural identification
CAS#[936563-96-1]
G-codeGEO-04903
SMILESC=CC(=O)N1CCC[C@H](C1)N2C3=NC=NC(=C3C(=N2)C4=CC=C(C=C4)OC5=CC=CC=C5)N
InChIInChI=1S/C25H24N6O2/c1-2-21(32)30-14-6-7-18(15-30)31-25-22(24(26)27-16-28-25)23(29-31)17-10-12-20(13-11-17)33-19-8-4-3-5-9-19/h2-5,8-13,16,18H,1,6-7,14-15H2,(H2,26,27,28)/t18-/m1/s1
InChI KeyInChIKey=XYFPWWZEPKGCCK-GOSISDBHSA-N
Regulatory Information
This product has not been classified.