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CS-W001157 4
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Methyl 1-((2'-cyano-[1,1'-biphenyl]-4-yl)methyl)-2-ethoxy-1H-benzo[d]imidazole-7-carboxylate

  • CAS No. 139481-44-0

  • Cat. No. CS-0151435
  • Purity≥97%
  • MDL No.MFCD09031384

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

Methyl 1-((2'-cyano-[1,1'-biphenyl]-4-yl)methyl)-2-ethoxy-1H-benzo[d]imidazole-7-carboxylate|CS-0151435

Structure of 139481-44-0

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General Information

  • CAS No. 139481-44-0
  • Cat. No. CS-0151435
  • Purity ≥97%
  • MDL No. MFCD09031384
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₂₅H₂₁N₃O₃
  • Molecular Weight 411.46
  • Synonym(s) Methyl 1-[(2'-cyanobiphenyl-4-yl)methyl]-2-ethoxy-benzimidazole-7-carboxylate
  • SMILES N#CC=1C=CC=CC1C=2C=CC(=CC2)CN3C(=NC=4C=CC=C(C(=O)OC)C43)OCC

Synthesis

  • Route1
    • In-stock
      Tetraethyl orthocarbonate|CS-0031801
      78-09-1
    • null|null
      136304-78-4
    • ~93%
    • In-stock
      Methyl 1-((2'-cyano-[1,1'-biphenyl]-4-yl)methyl)-2-ethoxy-1H-benzo[d]imidazole-7-carboxylate|CS-0151435
      139481-44-0

    References

    • Kubo, Keiji; Kohara, Yasuhisa; Imamiya, Eiko; Sugiura, Yoshihiro; Inada, Yoshiyuki; et al. Journal of Medicinal Chemistry, 1993 , vol. 36, # 15 p. 2182 - 2195
  • Route2

    References

    • WO2006/15134 A1, ; Page/Page column 16; 21-22 ;
  • Route3

    References

    • Journal of Medicinal Chemistry, , vol. 36, # 15 p. 2182 - 2195

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   77.14
  • LogP   4.80858
  • H_Acceptors   6
  • H_Donors   0
  • Rotatable_Bonds   6

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