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CS-W001157 4
Total: USD 88.00

N-(1-(1H-benzo[d][1,2,3]triazol-1-yl)-2,2-dimethylpropyl)-2-(3,4-dimethoxyphenyl)acetamide

  • CAS No. 861393-66-0

  • Cat. No. CS-M0063
  • Purity≥98%
  • MDL No.None

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

N-(1-(1H-benzo[d][1,2,3]triazol-1-yl)-2,2-dimethylpropyl)-2-(3,4-dimethoxyphenyl)acetamide|CS-M0063

Structure of 861393-66-0

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General Information

  • CAS No. 861393-66-0
  • Cat. No. CS-M0063
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₂₁H₂₆N₄O₃
  • Molecular Weight 382.46
  • Synonym(s) N-[1-(1H-Benzotriazol-1-yl)-2,2-dimethylpropyl]-3,4-dimethoxybenzeneacetamide
  • SMILES O=C(CC1=CC=C(C(OC)=C1)OC)NC(C(C)(C)C)N2N=NC3=CC=CC=C23

Synthesis

  • Route1

    References

    • Perez-Medrano, Arturo; Donnelly-Roberts, Diana L.; Honore, Prisca; Hsieh, Gin C.; Namovic, Marian T.; Peddi, Sridhar; Shuai, Qi; Wang, Ying; Faltynek, Connie R.; Jarvis, Michael F.; Carroll, William A. Journal of Medicinal Chemistry, 2009 , vol. 52, # 10 p. 3366 - 3376
  • Route2
    • 3,4-Dimethoxyphenylacetic acid Ivabradine Impurity|CS-0214068
      93-40-3
    • ~%
    • N-(1-(1H-benzo[d][1,2,3]triazol-1-yl)-2,2-dimethylpropyl)-2-(3,4-dimethoxyphenyl)acetamide|CS-M0063
      861393-66-0

    References

    • Gudaparthi, Vijayalakshmi; Bharathi; Panda, Jagadeesh Asian Journal of Chemistry, 2010 , vol. 22, # 7 p. 5323 - 5330
  • Route3

    References

    • Gudaparthi, Vijayalakshmi; Bharathi; Panda, Jagadeesh Asian Journal of Chemistry, 2010 , vol. 22, # 7 p. 5323 - 5330

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   78.27
  • LogP   3.3521
  • H_Acceptors   6
  • H_Donors   1
  • Rotatable_Bonds   6

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