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CS-W001157 4
Total: USD 88.00

Tert-butyl 4-(pyrimidin-2-ylamino)piperidine-1-carboxylate

  • CAS No. 301225-40-1

  • Cat. No. CS-0366458
  • Molecule weight278.35
  • Purity95+%
  • MDL No.None

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

Tert-butyl 4-(pyrimidin-2-ylamino)piperidine-1-carboxylate|CS-0366458

Structure of 301225-40-1

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General Information

  • CAS No. 301225-40-1
  • Cat. No. CS-0366458
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₂₂N₄O₂
  • Molecular Weight 278.35
  • Synonym(s) TERT-BUTYL 4-(2-PYRIMIDINYLAMINO)TETRAHYDRO-1(2H)-PYRIDINECARBOXYLATE
  • SMILES CC(C)(C)OC(=O)N1CCC(CC1)NC2=NC=CC=N2

Synthesis

  • Route1

    References

    • BOEHRINGER INGELHEIM INTERNATIONAL GMBH; BOEHRINGER INGELHEIM PHARMA GMBH and CO. KG Patent: WO2007/106705 A1, 2007 ; Location in patent: Page/Page column 102 ; WO 2007/106705 A1
  • Route2
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      79099-07-3
    • ~%
    • Tert-butyl 4-(pyrimidin-2-ylamino)piperidine-1-carboxylate|CS-0366458
      301225-40-1

    References

    • Willoughby, Christopher A.; Rosauer, Keith G.; Hale, Jeffery J.; Budhu, Richard J.; Mills, Sander G.; Chapman, Kevin T.; MacCoss, Malcolm; Malkowitz, Lorraine; Springer, Martin S.; Gould, Sandra L.; DeMartino, Julie A.; Siciliano, Salvatore J.; Cascieri, Margaret A.; Carella, Anthony; Carver, Gwen; Holmes, Karen; Schleif, William A.; Danzeisen, Renee; Hazuda, Daria; Kessler, Joseph; Lineberger, Janet; Miller, Michael; Emini, Emilio A. Bioorganic and Medicinal Chemistry Letters, 2003 , vol. 13, # 3 p. 427 - 431
  • Route3

    References

    • Willoughby, Christopher A.; Rosauer, Keith G.; Hale, Jeffery J.; Budhu, Richard J.; Mills, Sander G.; Chapman, Kevin T.; MacCoss, Malcolm; Malkowitz, Lorraine; Springer, Martin S.; Gould, Sandra L.; DeMartino, Julie A.; Siciliano, Salvatore J.; Cascieri, Margaret A.; Carella, Anthony; Carver, Gwen; Holmes, Karen; Schleif, William A.; Danzeisen, Renee; Hazuda, Daria; Kessler, Joseph; Lineberger, Janet; Miller, Michael; Emini, Emilio A. Bioorganic and Medicinal Chemistry Letters, 2003 , vol. 13, # 3 p. 427 - 431

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H320
Precautionary Statements : P264-P280-P302+P352-P305+P351+P338-P362

Quality Control

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Computational Chemistry Data

  • TPSA   67.35
  • LogP   2.288
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   2

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