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CS-W001157 4
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6-Amino-1-benzyl-5-(methylamino)-1,2,3,4-tetrahydropyrimidine-2,4-dione

  • CAS No. 72816-88-7

  • Cat. No. CS-0219035
  • Molecule weight246.27
  • Purity≥97%
  • MDL No.None

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

6-Amino-1-benzyl-5-(methylamino)-1,2,3,4-tetrahydropyrimidine-2,4-dione|CS-0219035

Structure of 72816-88-7

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General Information

  • CAS No. 72816-88-7
  • Cat. No. CS-0219035
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₄N₄O₂
  • Molecular Weight 246.27
  • Synonym(s) 6-Amino-1-benzyl-5-methylaminouracil
  • SMILES CNC1=C(N(C(NC1=O)=O)CC2=CC=CC=C2)N

Synthesis

  • Route1

    References

    • Alphey, Magnus S.; Pirrie, Lisa; Torrie, Leah S.; Boulkeroua, Wassila Abdelli; Gardiner, Mary; Sarkar, Aurijit; Maringer, Marko; Oehlmann, Wulf; Brenk, Ruth; Scherman, Michael S.; McNeil, Michael; Rejzek, Martin; Field, Robert A.; Singh, Mahavir; Gray, David; Westwood, Nicholas J.; Naismith, James H. ACS Chemical Biology, 2013 , vol. 8, # 2 p. 387 - 396
  • Route2
    • 6-Amino-1-benzyl-5-bromouracil|CS-D0175
      72816-87-6
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      74-89-5
    • ~%
    • 6-Amino-1-benzyl-5-(methylamino)-1,2,3,4-tetrahydropyrimidine-2,4-dione|CS-0219035
      72816-88-7

    References

    • Journal of Medicinal Chemistry, , vol. 45, # 16 p. 3440 - 3450
  • Route3

    References

    • Journal of Medicinal Chemistry, , vol. 45, # 16 p. 3440 - 3450

Safety Information

Download SDS
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

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Computational Chemistry Data

  • TPSA   92.91
  • LogP   0.2088
  • H_Acceptors   5
  • H_Donors   3
  • Rotatable_Bonds   3

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