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CS-W001157 4
Total: USD 88.00

5-[(3-chlorophenyl)methyl]-1,3,4-thiadiazol-2-amine

  • CAS No. 39181-49-2

  • Cat. No. CS-0264657
  • Molecule weight225.70
  • Purity≥97%
  • MDL No.None

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

5-[(3-chlorophenyl)methyl]-1,3,4-thiadiazol-2-amine|CS-0264657

Structure of 39181-49-2

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General Information

  • CAS No. 39181-49-2
  • Cat. No. CS-0264657
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₈ClN₃S
  • Molecular Weight 225.70
  • Synonym(s) 5-(3-chlorobenzyl)-1,3,4-thiadiazol-2-amine
  • SMILES NC1=NN=C(CC2=CC=CC(Cl)=C2)S1

Synthesis

  • Route1

    References

    • Wickham, Stephanie; Regan, Nicholas; West, Matthew B.; Kumar, Vidya Prasanna; Thai, Justin; Li, Pui Kai; Cook, Paul F.; Hanigan, Marie H. Journal of Enzyme Inhibition and Medicinal Chemistry, 2012 , vol. 27, # 4 p. 476 - 489

Safety Information

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

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Computational Chemistry Data

  • TPSA   51.8
  • LogP   2.3645
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   2

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