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CS-W001157 4
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2-Thioxo-2,3,6,7-tetrahydro-1H-cyclopenta[d]pyrimidin-4(5H)-one

  • CAS No. 35563-27-0

  • Cat. No. CS-M1753
  • Molecule weight168.22
  • Purity≥95%
  • MDL No.MFCD00223637

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

2-Thioxo-2,3,6,7-tetrahydro-1H-cyclopenta[d]pyrimidin-4(5H)-one|CS-M1753

Structure of 35563-27-0

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General Information

  • CAS No. 35563-27-0
  • Cat. No. CS-M1753
  • Purity ≥95%
  • MDL No. MFCD00223637
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₈N₂OS
  • Molecular Weight 168.22
  • Synonym(s) 2-thioxo-1,2,3,5,6,7-hexahydro-4H-cyclopenta[d]pyrimidin-4-one
  • SMILES S=C(N1)NC2=C(CCC2)C1=O

Synthesis

  • Route1

    References

    • Campiani; Morelli; Nacci; Fattorusso; Ramunno; Novellino; Greenwood; Liljefors; Griffiths; Sinclair; Reavy; Kristensen; Pickering; Schousboe; Cagnotto; Fumagalli; Mennini Journal of Medicinal Chemistry, 2001 , vol. 44, # 26 p. 4501 - 4504
  • Route2

    References

    • Roth, Joshua; Minond, Dmitriy; Darout, Etzer; Liu, Qin; Lauer, Janelle; Hodder, Peter; Fields, Gregg B.; Roush, William R. Bioorganic and Medicinal Chemistry Letters, 2011 , vol. 21, # 23 p. 7180 - 7184

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-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   48.65
  • LogP   0.92119
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   0

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