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6-Amino-1-benzyl-3-methylpyrimidine-2,4(1H,3H)-dione

  • CAS No. 53681-51-9

  • Cat. No. CS-0132156
  • Purity≥95%
  • MDL No.MFCD03480188

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

6-Amino-1-benzyl-3-methylpyrimidine-2,4(1H,3H)-dione|CS-0132156

Structure of 53681-51-9

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General Information

  • CAS No. 53681-51-9
  • Cat. No. CS-0132156
  • Purity ≥95%
  • MDL No. MFCD03480188
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₃N₃O₂
  • Molecular Weight 231.25
  • Synonym(s) 6-amino-1-benzyl-3-methylpyrimidine-2,4-dione
  • SMILES O=C1N(C)C(C=C(N)N1CC2=CC=CC=C2)=O

Synthesis

  • Route1

    References

    • Agostini; Bonacchi; Coppini; Di Marco; Paoli; Toja Arzneimittel-Forschung/Drug Research, 1995 , vol. 45, # 6 p. 684 - 688
  • Route2
    • 1-Benzyl-3-methylurea|CS-0589818
      6957-05-7
    • null|null
      372-09-8
    • ~%
    • 6-Amino-1-benzyl-3-methylpyrimidine-2,4(1H,3H)-dione|CS-0132156
      53681-51-9

    References

    • Merlos; Gomez; Vericat; Bartroli; Garcia-Rafanell; Forn European Journal of Medicinal Chemistry, 1990 , vol. 25, # 8 p. 653 - 658

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

Quality Control

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Computational Chemistry Data

  • TPSA   70.02
  • LogP   0.1775
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   2

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