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CS-W001157 4
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2-(Chloromethyl)-5-(4-chlorophenyl)-3h,4h-thieno[2,3-d]pyrimidin-4-one

  • CAS No. 91225-69-3

  • Cat. No. CS-0221072
  • Molecule weight311.19
  • Purity≥97%
  • MDL No.None

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

2-(Chloromethyl)-5-(4-chlorophenyl)-3h,4h-thieno[2,3-d]pyrimidin-4-one|CS-0221072

Structure of 91225-69-3

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General Information

  • CAS No. 91225-69-3
  • Cat. No. CS-0221072
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₈Cl₂N₂OS
  • Molecular Weight 311.19
  • Synonym(s) 2-(chloromethyl)-5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4(3H)-one
  • SMILES C1=C(C=CC(=C1)Cl)C2=CSC3=NC(=NC(=C23)O)CCl

Synthesis

  • Route1
    • Ethyl 2-amino-4-(4-chlorophenyl)thiophene-3-carboxylate|CS-0071469
      65234-09-5
    • null|null
      107-14-2
    • ~78%
    • 2-(Chloromethyl)-5-(4-chlorophenyl)-3h,4h-thieno[2,3-d]pyrimidin-4-one|CS-0221072
      91225-69-3

    References

    • Kathiravan, Matthu K.; Shishoo, Chamanlal J.; Kumar, Krishnan Girish; Roy, Saroj Kumar; Mahadik, Kakasheb R.; Kadam, Shivajirao S.; Jain, Kishor S. Arzneimittel-Forschung/Drug Research, 2007 , vol. 57, # 9 p. 599 - 606

Safety Information

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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

Quality Control

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Computational Chemistry Data

  • TPSA   46.01
  • LogP   4.4561
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   2

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