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CAS 145783-13-7

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6-Hydroxy-5-nitro-2-(propylthio)-4(3H)-pyrimidinone

Description:
6-Hydroxy-5-nitro-2-(propylthio)-4(3H)-pyrimidinone, with the CAS number 145783-13-7, is a chemical compound that belongs to the class of pyrimidinones, which are characterized by a six-membered aromatic ring containing nitrogen atoms. This particular compound features a hydroxyl group (-OH) and a nitro group (-NO2) at specific positions on the pyrimidine ring, contributing to its reactivity and potential biological activity. The presence of a propylthio group (-S-CH2-CH2-CH3) enhances its lipophilicity, which may influence its solubility and permeability in biological systems. The compound's structure suggests potential applications in medicinal chemistry, possibly as an antimicrobial or anti-inflammatory agent, although specific biological activities would require further investigation. Additionally, its stability, solubility, and reactivity can be influenced by environmental factors such as pH and temperature. As with many chemical substances, safety data and handling precautions should be considered when working with this compound in a laboratory setting.
Formula:C7H9N3O4S
InChI:InChI=1S/C7H9N3O4S/c1-2-3-15-7-8-5(11)4(10(13)14)6(12)9-7/h2-3H2,1H3,(H2,8,9,11,12)
InChI key:InChIKey=PHMVMACIFWKESN-UHFFFAOYSA-N
SMILES:N(=O)(=O)C=1C(=O)NC(SCCC)=NC1O
Synonyms:
  • 5-Nitro-2-(propylthio)pyrimidine-4,6-diol
  • 4(1H)-Pyrimidinone, 6-hydroxy-5-nitro-2-(propylthio)-
  • 4(3H)-Pyrimidinone, 6-hydroxy-5-nitro-2-(propylthio)-
  • 6-Hydroxy-5-nitro-2-(propylthio)-4(3H)-pyrimidinone
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