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CS-W001157 4
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(4-(Methylamino)-2-(methylthio)pyrimidin-5-yl)methanol

  • CAS No. 17759-30-7

  • Cat. No. CS-0018973
  • Purity≥96%
  • MDL No.MFCD16293863

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

(4-(Methylamino)-2-(methylthio)pyrimidin-5-yl)methanol|CS-0018973

Structure of 17759-30-7

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General Information

  • CAS No. 17759-30-7
  • Cat. No. CS-0018973
  • Purity ≥96%
  • MDL No. MFCD16293863
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₁₁N₃OS
  • Molecular Weight 185.25
  • Synonym(s) (4-(Methylamino)-2-(methylthio)pyrimidin-5-yl)methanol; (4-Methylamino-2-methanethiopyrimidin-5-yl)methanol; 4-(Methylamino)-2-(methylthio)pyrimidine-5-methanol
  • SMILES OCC1=CN=C(SC)N=C1NC

Synthesis

  • Route1

    References

    • DECIPHERA PHARMACEUTICALS, LLC Patent: WO2008/33999 A2, 2008 ; Location in patent: Page/Page column 88 ;
  • Route2
    • Ethyl 4-chloro-2-(methylthio)pyrimidine-5-carboxylate Avanafil  Impurity|CS-0228709
      5909-24-0
    • ~%
    • In-stock
      (4-(Methylamino)-2-(methylthio)pyrimidin-5-yl)methanol|CS-0018973
      17759-30-7

    References

    • Journal of Medicinal Chemistry, , vol. 41, # 17 p. 3276 - 3292

Safety Information

Download SDS
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

Quality Control

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Computational Chemistry Data

  • TPSA   58.04
  • LogP   0.7325
  • H_Acceptors   5
  • H_Donors   2
  • Rotatable_Bonds   3

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