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CS-W001157 4
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Benzyl 2-(2-benzyl-3-mercaptopropanamido)acetate Racecadotril Impurity

  • CAS No. 81110-69-2

  • Cat. No. CS-0533333
  • Purity≥98%
  • MDL No.None

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

Benzyl 2-(2-benzyl-3-mercaptopropanamido)acetate Racecadotril Impurity|CS-0533333

Structure of 81110-69-2

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General Information

  • CAS No. 81110-69-2
  • Cat. No. CS-0533333
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₉H₂₁NO₃S
  • Molecular Weight 343.44
  • Synonym(s) Benzyl 2-(2-benzyl-3-mercaptopropanamido)acetate
  • SMILES O=C(CNC(C(CC1=CC=CC=C1)CS)=O)OCC2=CC=CC=C2

Synthesis

  • Route1
    • Dibenzyl 2,2'-((3,3'-disulfanediylbis(2-benzylpropanoyl))bis(azanediyl))diacetate Racecadotril Impurity|CS-0533335
      141437-88-9
    • ~95%
    • Benzyl 2-(2-benzyl-3-mercaptopropanamido)acetate Racecadotril Impurity|CS-0533333
      81110-69-2

    References

    • Fournie-Zaluski, Marie-Claude; Coric, Pascal; Turcaud, Serge; Lucas, Evelyne; Noble, Florence; et al. Journal of Medicinal Chemistry, 1992 ,  vol. 35,  # 13  p. 2473 - 2481

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   55.4
  • LogP   2.6347
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   8

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