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CS-W001157 4
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Isopropyl 6-methyl-4-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

  • CAS No. 321691-00-3

  • Cat. No. CS-0367342
  • Purity≥98%
  • MDL No.None

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

Isopropyl 6-methyl-4-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate|CS-0367342

Structure of 321691-00-3

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General Information

  • CAS No. 321691-00-3
  • Cat. No. CS-0367342
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₅H₁₈N₂O₂S
  • Molecular Weight 290.38
  • Synonym(s) propan-2-yl 4-methyl-6-phenyl-2-sulfanyl-1,6-dihydropyrimidine-5-carboxylate
  • SMILES CC(OC(C1=C(NC(NC1C2=CC=CC=C2)=S)C)=O)C

Synthesis

  • Route1
    • In-stock
      Isopropyl 3-oxobutanoate|CS-0179766
      542-08-5
    • null|null
      100-52-7
    • null|null
      17356-08-0
    • ~90%
    • Isopropyl 6-methyl-4-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate|CS-0367342
      321691-00-3

    References

    • Chitra; Devanathan; Pandiarajan European Journal of Medicinal Chemistry, 2010 , vol. 45, # 1 p. 367 - 371

Safety Information

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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   50.36
  • LogP   2.431
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   3

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