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CS-W001157 4
Total: USD 88.00

1-((R)-3-(5-(3-((R)-3-(4-amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl)piperidin-1-yl)-3-oxopropyl)-4-imino-3-(4-phenoxyphenyl)-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-1-yl)piperidin-1-yl)prop-2-en-1-one Ibrutinib Impurity

  • CAS No. 2417548-76-4

  • Cat. No. CS-0164744
  • Purity≥98%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

1-((R)-3-(5-(3-((R)-3-(4-amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl)piperidin-1-yl)-3-oxopropyl)-4-imino-3-(4-phenoxyphenyl)-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-1-yl)piperidin-1-yl)prop-2-en-1-one  Ibrutinib Impurity|CS-0164744

Structure of 2417548-76-4

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General Information

  • CAS No. 2417548-76-4
  • Cat. No. CS-0164744
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅₀H₄₈N₁₂O₄
  • Molecular Weight 880.99
  • Synonym(s) None
  • SMILES C=CC(N1C[C@H](N2N=C(C3=CC=C(OC4=CC=CC=C4)C=C3)C5=C2N=CN(CCC(N6C[C@H](N7N=C(C8=CC=C(OC9=CC=CC=C9)C=C8)C%10=C(N)N=CN=C%107)CCC6)=O)C5=N)CCC1)=O

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   188.19
  • LogP   7.95607
  • H_Acceptors   14
  • H_Donors   2
  • Rotatable_Bonds   12

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