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4-Chloro-7-(4-methoxybenzyl)-6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidine

  • CAS No. 853680-76-9

  • Cat. No. CS-0099965
  • Purity98+%
  • MDL No.MFCD12400763

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

4-Chloro-7-(4-methoxybenzyl)-6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidine|CS-0099965

Structure of 853680-76-9

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General Information

  • CAS No. 853680-76-9
  • Cat. No. CS-0099965
  • Purity 98+%
  • MDL No. MFCD12400763
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₁₄ClN₃O
  • Molecular Weight 275.73
  • Synonym(s) 4-chloro-7-[(4-methoxyphenyl)methyl]-5,6-dihydropyrrolo[2,3-d]pyrimidine
  • SMILES COC1=CC=C(CN2CCC3=C(Cl)N=CN=C32)C=C1

Synthesis

  • Route1
    • null|null
      853680-75-8
    • null|null
      2393-23-9
    • ~71%
    • 4-Chloro-7-(4-methoxybenzyl)-6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidine|CS-0099965
      853680-76-9

    References

    • ARRAY BIOPHARMA INC. Patent: WO2005/51304 A2, 2005 ; Location in patent: Page/Page column 155-157 ; WO 2005/051304 A2
  • Route2

    References

    • WO2014/19908 A2, ;
  • Route3
    • null|null
      2393-23-9
    • ~%
    • 4-Chloro-7-(4-methoxybenzyl)-6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidine|CS-0099965
      853680-76-9

    References

    • WO2014/19908 A2, ;

Safety Information

Download SDS
GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   38.25
  • LogP   2.7013
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   3

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