Cas no 1276197-36-4 ((±)-Atropine-d3 (N-methyl-d3))

(±)-Atropine-d3 (N-methyl-d3) is a deuterated analog of atropine, where three hydrogen atoms on the N-methyl group are replaced with deuterium. This isotopically labeled compound is primarily used as an internal standard in quantitative mass spectrometry, ensuring high accuracy and precision in pharmacokinetic and metabolic studies. The incorporation of deuterium minimizes interference from endogenous compounds, enhancing analytical specificity. Its stability under physiological conditions makes it suitable for tracing atropine and its metabolites in complex biological matrices. The compound is synthesized with high isotopic purity (>98%), ensuring reliable performance in research applications. (±)-Atropine-d3 is particularly valuable in drug development and forensic toxicology for its consistent reproducibility and reduced matrix effects.
(±)-Atropine-d3 (N-methyl-d3) structure
(±)-Atropine-d3 (N-methyl-d3) structure
Product Name:(±)-Atropine-d3 (N-methyl-d3)
CAS No:1276197-36-4
MF:C17H23NO3
MW:292.39
CID:1066059
PubChem ID:162641998
Update Time:2025-06-15

(±)-Atropine-d3 (N-methyl-d3) Chemical and Physical Properties

Names and Identifiers

    • (±)-Atropine-d3?(N-methyl-d3)
    • (±)-Atropine-d3 (N-methyl-d3)
    • D3-Atropine
    • (Rac)-Atropine-d
    • 1276197-36-4
    • [8-(trideuteriomethyl)-8-azabicyclo[3.2.1]octan-3-yl] 3-hydroxy-2-phenylpropanoate
    • CS-0226479
    • MS-24185
    • F90510
    • HY-B1205S
    • (Rac)-Atropine-d3
    • (+/-)-ATROPINE-D3
    • Inchi: 1S/C17H23NO3/c1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12/h2-6,13-16,19H,7-11H2,1H3
    • InChI Key: RKUNBYITZUJHSG-UHFFFAOYSA-N
    • SMILES: O(C1CC2CCC(N2C([H])([H])[H])C1)C(=O)C(C1C=CC=CC=1)CO

Computed Properties

  • Exact Mass: 292.18662383g/mol
  • Monoisotopic Mass: 292.18662383g/mol
  • Isotope Atom Count: 3
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 5
  • Complexity: 353
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 3
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.8
  • Topological Polar Surface Area: 49.8?2

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(±)-Atropine-d3 (N-methyl-d3) Suppliers

Amadis Chemical Company Limited
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Audited Supplier Audited Supplier
(CAS:1276197-36-4)(Rac)-Atropine-d
Order Number:A1011018
Stock Status:in Stock
Quantity:1mg/5mg
Purity:99%
Pricing Information Last Updated:Thursday, 29 August 2024 15:11
Price ($):395.0/1072.0

Additional information on (±)-Atropine-d3 (N-methyl-d3)

Introduction to (±)-Atropine-d3 (N-methyl-d3) and Its Applications in Modern Research

Chemical compounds play a pivotal role in the advancement of pharmaceutical research and development. Among these, (±)-Atropine-d3 (N-methyl-d3), identified by its CAS number 1276197-36-4, stands out as a significant isotope-labeled compound with diverse applications in the field of medicinal chemistry. This compound, characterized by its deuterium-labeled structure, offers unique advantages in analytical and synthetic chemistry, particularly in the study of pharmacokinetics and metabolic pathways.

The CAS number 1276197-36-4 provides a unique identifier for this compound, ensuring precise classification and differentiation in chemical databases and research literature. The presence of deuterium atoms in (±)-Atropine-d3 (N-methyl-d3) enhances its stability and isotopic purity, making it an invaluable tool for researchers aiming to investigate the detailed mechanisms of drug metabolism and interaction with biological targets.

In recent years, the demand for high-purity labeled compounds has surged due to their critical role in nuclear magnetic resonance (NMR) spectroscopy and mass spectrometry (MS) analyses. These techniques are indispensable for elucidating the structural properties of complex molecules. The (±)-Atropine-d3 (N-methyl-d3) compound serves as an excellent probe for these analytical methods, providing clear and interpretable spectral data that aid in the characterization of pharmaceutical intermediates and active pharmaceutical ingredients (APIs).

One of the most compelling applications of (±)-Atropine-d3 (N-methyl-d3) is in the field of drug discovery and development. Its labeled structure allows researchers to track the metabolic fate of atropine derivatives, offering insights into how these compounds are processed within living systems. This information is crucial for optimizing drug formulations and predicting potential side effects. The use of deuterium-labeled compounds has revolutionized the way metabolic studies are conducted, providing a non-invasive yet highly accurate method for understanding drug interactions at the molecular level.

Moreover, the CAS number 1276197-36-4 associated with (±)-Atropine-d3 (N-methyl-d3) facilitates seamless integration into existing chemical databases and research platforms. This compatibility ensures that researchers can easily access relevant data, including safety profiles, solubility information, and spectral references, thereby streamlining the research process. The compound's isotopic purity also minimizes background noise in analytical experiments, leading to more reliable and reproducible results.

The significance of (±)-Atropine-d3 (N-methyl-d3) extends beyond academic research. Pharmaceutical companies leveraging advanced labeling technologies are able to develop more effective drugs with improved safety profiles. The ability to monitor drug metabolism in real-time using labeled compounds like this one has led to significant breakthroughs in personalized medicine. By understanding how individual patients metabolize drugs, healthcare providers can tailor treatments to specific genetic profiles, enhancing therapeutic outcomes.

Recent studies have highlighted the role of isotopically labeled compounds in studying enzyme kinetics and binding interactions. For instance, researchers have utilized (±)-Atropine-d3 (N-methyl-d3) to investigate how atropine derivatives interact with muscarinic receptors. These studies have not only deepened our understanding of receptor mechanisms but also paved the way for new therapeutic strategies targeting neurological disorders such as Alzheimer's disease and myasthenia gravis.

The versatility of (±)-Atropine-d3 (N-methyl-d3) is further demonstrated by its use in synthetic chemistry. Its stable deuterium atoms serve as handles for synthetic modifications, allowing chemists to design complex molecules with enhanced isotopic enrichment. This capability is particularly valuable in multi-step synthesis where maintaining high levels of purity is essential. The compound's compatibility with various reaction conditions makes it a preferred choice for researchers aiming to push the boundaries of synthetic methodologies.

In conclusion, (±)-Atropine-d3 (N-methyl-d3) stands as a cornerstone in modern chemical research due to its unique properties and broad applicability. The combination of its precise CAS number 1276197-36-4 and isotopic labeling offers unparalleled opportunities for advancing our understanding of drug metabolism, receptor interactions, and synthetic chemistry. As research continues to evolve, compounds like this will undoubtedly play a central role in shaping the future of pharmaceutical science.

Recommended suppliers
Amadis Chemical Company Limited
(CAS:1276197-36-4)(Rac)-Atropine-d
A1011018
Purity:99%/99%
Quantity:1mg/5mg
Price ($):395.0/1072.0
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