Cas no 32249-40-4 (6-cyclopropyl-5-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one)

6-Cyclopropyl-5-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one is a heterocyclic compound featuring a pyrimidinone core with a cyclopropyl substituent and a thione functional group. This structure imparts unique reactivity and potential utility in medicinal chemistry and agrochemical applications. The cyclopropyl group enhances steric and electronic properties, while the thione moiety offers versatility as a nucleophile or metal-binding site. Its tetrahydropyrimidin-4-one scaffold is of interest for designing enzyme inhibitors or bioactive intermediates. The compound's stability and synthetic accessibility make it a valuable building block for further derivatization in pharmaceutical and materials research.
6-cyclopropyl-5-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one structure
32249-40-4 structure
Product Name:6-cyclopropyl-5-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one
CAS No:32249-40-4
MF:C8H10N2OS
MW:182.242800235748
CID:1081219
PubChem ID:12512042
Update Time:2025-08-02

6-cyclopropyl-5-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one Chemical and Physical Properties

Names and Identifiers

    • 6-Cyclopropyl-2-mercapto-5-methylpyrimidin-4-ol
    • 6-cyclopropyl-5-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one
    • 32249-40-4
    • 6-CYCLOPROPYL-5-METHYL-2-SULFANYLPYRIMIDIN-4-OL
    • F1911-3005
    • AKOS040799173
    • 6-cyclopropyl-5-methyl-2-sulfanylidene-1H-pyrimidin-4-one
    • Inchi: 1S/C8H10N2OS/c1-4-6(5-2-3-5)9-8(12)10-7(4)11/h5H,2-3H2,1H3,(H2,9,10,11,12)
    • InChI Key: ATMZBFIDDBCNMF-UHFFFAOYSA-N
    • SMILES: S=C1NC(C(C)=C(C2CC2)N1)=O

Computed Properties

  • Exact Mass: 182.05138412g/mol
  • Monoisotopic Mass: 182.05138412g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 1
  • Complexity: 291
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0.6
  • Topological Polar Surface Area: 73.2?2

6-cyclopropyl-5-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one Pricemore >>

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Additional information on 6-cyclopropyl-5-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one

Comprehensive Overview of 6-cyclopropyl-5-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one (CAS No. 32249-40-4)

6-cyclopropyl-5-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one (CAS No. 32249-40-4) is a heterocyclic compound that has garnered significant attention in pharmaceutical and agrochemical research. This compound belongs to the pyrimidinone family, which is known for its diverse biological activities. The presence of a cyclopropyl group and a sulfanylidene moiety in its structure enhances its potential for various applications, making it a subject of interest for researchers and industry professionals alike.

The molecular formula of 6-cyclopropyl-5-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one is C8H10N2OS, with a molecular weight of 182.24 g/mol. Its unique structural features, including the tetrahydropyrimidin-4-one core, contribute to its stability and reactivity, which are critical for its applications in drug discovery and material science. The compound's CAS No. 32249-40-4 serves as a unique identifier, ensuring accurate referencing in scientific literature and commercial databases.

One of the key reasons for the growing interest in 6-cyclopropyl-5-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one is its potential as a building block in medicinal chemistry. Researchers are exploring its role in the synthesis of novel antimicrobial and anti-inflammatory agents. The sulfanylidene group, in particular, is known to interact with biological targets, making it a valuable moiety for drug design. Additionally, the cyclopropyl ring can influence the compound's pharmacokinetic properties, such as metabolic stability and bioavailability.

In the agrochemical sector, 6-cyclopropyl-5-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one is being investigated for its potential as a precursor to pesticides and herbicides. The compound's ability to modulate enzyme activity in pests and weeds makes it a promising candidate for sustainable agricultural solutions. With the increasing demand for eco-friendly agrochemicals, this compound aligns well with current trends in green chemistry and sustainable farming practices.

The synthesis of 6-cyclopropyl-5-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one typically involves multi-step reactions, starting from readily available precursors. Researchers have optimized these processes to improve yield and purity, ensuring the compound's suitability for large-scale applications. Advanced analytical techniques, such as NMR spectroscopy and mass spectrometry, are employed to confirm its structure and purity, which are critical for its use in high-value applications.

From a market perspective, the demand for 6-cyclopropyl-5-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one is expected to grow, driven by its versatility in pharmaceutical and agrochemical industries. Companies specializing in fine chemicals and custom synthesis are increasingly offering this compound to meet the needs of research and development teams. Its CAS No. 32249-40-4 is frequently searched in chemical databases, reflecting its relevance in contemporary scientific inquiries.

In conclusion, 6-cyclopropyl-5-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one (CAS No. 32249-40-4) is a compound of significant scientific and industrial interest. Its unique structural features and potential applications in drug discovery, agrochemicals, and material science make it a valuable subject for ongoing research. As the scientific community continues to explore its properties and applications, this compound is poised to play a pivotal role in addressing some of the most pressing challenges in healthcare and agriculture.

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