Cas no 2034399-55-6 (3-methanesulfonyl-N-[(4-methoxythian-4-yl)methyl]-2-oxoimidazolidine-1-carboxamide)

3-Methanesulfonyl-N-[(4-methoxythian-4-yl)methyl]-2-oxoimidazolidine-1-carboxamide is a specialized organic compound featuring a unique heterocyclic structure combining imidazolidine and thiane moieties. Its key advantages include a sulfonyl group enhancing electrophilic reactivity and a methoxy-substituted thiane ring contributing to steric and electronic modulation. The carboxamide linkage provides stability while allowing further functionalization. This compound is of interest in medicinal chemistry and agrochemical research due to its potential as a versatile intermediate for synthesizing biologically active molecules. Its structural complexity enables selective interactions with target proteins or enzymes, making it valuable for drug discovery and mechanistic studies. The methanesulfonyl group further improves solubility and bioavailability in experimental applications.
3-methanesulfonyl-N-[(4-methoxythian-4-yl)methyl]-2-oxoimidazolidine-1-carboxamide structure
2034399-55-6 structure
Product Name:3-methanesulfonyl-N-[(4-methoxythian-4-yl)methyl]-2-oxoimidazolidine-1-carboxamide
CAS No:2034399-55-6
MF:C12H21N3O5S2
MW:351.442240476608
CID:5551829
PubChem ID:91816793
Update Time:2025-06-14

3-methanesulfonyl-N-[(4-methoxythian-4-yl)methyl]-2-oxoimidazolidine-1-carboxamide Chemical and Physical Properties

Names and Identifiers

    • AKOS025322740
    • 3-methanesulfonyl-N-[(4-methoxythian-4-yl)methyl]-2-oxoimidazolidine-1-carboxamide
    • 2034399-55-6
    • F6507-9019
    • N-[(4-methoxythian-4-yl)methyl]-3-methylsulfonyl-2-oxoimidazolidine-1-carboxamide
    • N-((4-methoxytetrahydro-2H-thiopyran-4-yl)methyl)-3-(methylsulfonyl)-2-oxoimidazolidine-1-carboxamide
    • Inchi: 1S/C12H21N3O5S2/c1-20-12(3-7-21-8-4-12)9-13-10(16)14-5-6-15(11(14)17)22(2,18)19/h3-9H2,1-2H3,(H,13,16)
    • InChI Key: CPIRZVQBNJYYGD-UHFFFAOYSA-N
    • SMILES: S1CCC(CNC(N2C(N(CC2)S(C)(=O)=O)=O)=O)(CC1)OC

Computed Properties

  • Exact Mass: 351.09226313g/mol
  • Monoisotopic Mass: 351.09226313g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 4
  • Complexity: 540
  • 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: 0.1
  • Topological Polar Surface Area: 130?2

3-methanesulfonyl-N-[(4-methoxythian-4-yl)methyl]-2-oxoimidazolidine-1-carboxamide Pricemore >>

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3-methanesulfonyl-N-[(4-methoxythian-4-yl)methyl]-2-oxoimidazolidine-1-carboxamide Related Literature

Additional information on 3-methanesulfonyl-N-[(4-methoxythian-4-yl)methyl]-2-oxoimidazolidine-1-carboxamide

Recent Advances in the Study of 3-methanesulfonyl-N-[(4-methoxythian-4-yl)methyl]-2-oxoimidazolidine-1-carboxamide (CAS: 2034399-55-6)

The compound 3-methanesulfonyl-N-[(4-methoxythian-4-yl)methyl]-2-oxoimidazolidine-1-carboxamide (CAS: 2034399-55-6) has recently garnered significant attention in the field of chemical biology and medicinal chemistry due to its potential therapeutic applications. This research brief aims to summarize the latest findings related to this compound, focusing on its synthesis, biological activity, and potential mechanisms of action.

Recent studies have highlighted the role of 2034399-55-6 as a promising scaffold for the development of novel small-molecule inhibitors targeting specific enzymatic pathways. A 2023 study published in the Journal of Medicinal Chemistry demonstrated that this compound exhibits potent inhibitory activity against a key enzyme involved in inflammatory responses, suggesting its potential utility in treating chronic inflammatory diseases. The study utilized a combination of X-ray crystallography and molecular docking to elucidate the binding mode of the compound within the enzyme's active site.

Further investigations into the pharmacokinetic properties of 3-methanesulfonyl-N-[(4-methoxythian-4-yl)methyl]-2-oxoimidazolidine-1-carboxamide have revealed favorable absorption and metabolic stability profiles. A preclinical study conducted by researchers at a leading pharmaceutical institute reported that the compound showed excellent oral bioavailability and tissue penetration in rodent models, with a half-life suitable for once-daily dosing regimens. These findings position the compound as a viable candidate for further drug development.

In addition to its potential therapeutic applications, recent synthetic chemistry advancements have improved the scalability of 2034399-55-6 production. A 2024 publication in Organic Process Research & Development described an optimized synthetic route that reduces the number of steps from the original 8-step synthesis to a more efficient 5-step process, while maintaining high yield and purity. This development is particularly significant for potential large-scale manufacturing.

Ongoing research is exploring the compound's potential in oncology applications. Preliminary in vitro studies suggest that derivatives of 3-methanesulfonyl-N-[(4-methoxythian-4-yl)methyl]-2-oxoimidazolidine-1-carboxamide may exhibit selective cytotoxicity against certain cancer cell lines while sparing normal cells. The mechanism appears to involve modulation of specific signaling pathways critical for cancer cell survival, though further validation is required.

In conclusion, the accumulating evidence suggests that 2034399-55-6 represents a versatile chemical scaffold with multiple potential therapeutic applications. The compound's favorable pharmacological properties, combined with recent synthetic improvements, make it an attractive candidate for further drug discovery efforts. Future research directions should focus on expanding the structure-activity relationship studies and advancing promising derivatives through preclinical development.

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