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CS-W001157 4
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5-((2,4-Dichlorobenzyl)thio)-1H-1,2,4-triazol-3-amine

  • CAS No. 303150-34-7

  • Cat. No. CS-0333245
  • Molecule weight275.16
  • Purity≥97%
  • MDL No.None

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

5-((2,4-Dichlorobenzyl)thio)-1H-1,2,4-triazol-3-amine|CS-0333245

Structure of 303150-34-7

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General Information

  • CAS No. 303150-34-7
  • Cat. No. CS-0333245
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₈Cl₂N₄S
  • Molecular Weight 275.16
  • Synonym(s) 3-[(2,4-dichlorobenzyl)sulfanyl]-1H-1,2,4-triazol-5-amine
  • SMILES NC1=NNC(SCC2=CC=C(Cl)C=C2Cl)=N1

Synthesis

  • Route1
    • null|null
      118025-46-0
    • In-stock
      1-(Bromomethyl)-2,4-dichlorobenzene|CS-W021249
      20443-99-6
    • ~92%
    • 5-((2,4-Dichlorobenzyl)thio)-1H-1,2,4-triazol-3-amine|CS-0333245
      303150-34-7

    References

    • Wangtrakuldee, Phumvadee; Byrd, Matthew S.; Campos, Cristine G.; Henderson, Michael W.; Zhang, Zheng; Clare, Michael; Masoudi, Ali; Myler, Peter J.; Horn, James R.; Cotter, Peggy A.; Hagen, Timothy J. ACS Medicinal Chemistry Letters, 2013 , vol. 4, # 8 p. 699 - 703

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   67.59
  • LogP   2.986
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   3

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