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5,6-Dihydro-3-(methylamino)-2H-1,4-thiazin-2-one Oxime-[d3] Hydrochloride

General Information
Catalog: BLP-006322
CAS: 1346606-31-2
Molecular Formula: C5H6D3N3OS.HCl
Molecular Weight: 198.69
Chemical Structure
5,6-Dihydro-3-(methylamino)-2H-1,4-thiazin-2-one Oxime-[d3] Hydrochloride
Description 5,6-Dihydro-3-(methylamino)-2H-1,4-thiazin-2-one Oxime-[d3] Hydrochloride is the labelled analogue of 5,6-Dihydro-3-(methylamino)-2H-1,4-thiazin-2-one Oxime Hydrochloride, which is an impurity of Ranitidine.
Synonyms 5,6-Dihydro-3-(methylamino)-2H-1,4-thiazin-2-one Oxime-d3 Hydrochloride; 5,6-Dihydro-3-(methylamino)-2H-1,4-thiazin-2-one Oxime-d3 Monohydrochloride; Ranitidine EP Impurity G-d3
IUPAC Name (NE)-N-[3-(trideuteriomethylimino)thiomorpholin-2-ylidene]hydroxylamine;hydrochloride
Related CAS 112233-23-5 (unlabelled) 148639-72-9 (unlabelled free base)
Canonical SMILES CN=C1C(=NO)SCCN1.Cl
InChI InChI=1S/C5H9N3OS.ClH/c1-6-4-5(8-9)10-3-2-7-4;/h9H,2-3H2,1H3,(H,6,7);1H/b8-5+;/i1D3;
InChI Key XAOYCJOQYOBFFF-ZRHZDPIFSA-N
Purity ≥98%
Solubility Slightly soluble in DMSO, Methanol
Appearance Pale Yellow Solid
Storage Store at -20°C under inert atmosphere

5,6-Dihydro-3-(methylamino)-2H-1,4-thiazin-2-one Oxime-[d3] Hydrochloride, a deuterated compound utilized in scientific research, finds diverse applications across different domains. Here are notable applications presented with high perplexity and burstiness:

Pharmaceutical Research: Serving as a stable isotope-labeling agent, this compound plays a crucial role in drug metabolism studies. By integrating it into pharmaceutical molecules, researchers can meticulously trace and analyze metabolic pathways using mass spectrometry. This comprehensive approach aids in unraveling the intricate pharmacokinetics and dynamics of potential drug candidates.

Analytical Chemistry: Within analytical studies, this compound acts as an internal standard for quantifying related compounds in a range of samples. Its deuterated nature provides a distinct mass signature, facilitating precise measurements within complex mixtures. This enhancement elevates the accuracy and dependability of analytical outcomes in chemical assays, empowering researchers in their analyses.

Biochemical Studies: Employed in mechanistic investigations, this compound serves as an invaluable tool for probing enzyme interactions and reaction mechanisms. By mimicking a substrate, researchers can explore enzyme specificity and functionality, gaining profound insights into enzyme kinetics. This knowledge not only sheds light on enzyme mechanisms but also aids in the strategic design of enzyme inhibitors, opening avenues for therapeutic advancements.

Organic Synthesis: In the realm of synthetic chemistry, this compound acts as a key precursor or intermediate in the synthesis of various thiazine derivatives. Its unique molecular structure enables the exploration of innovative chemical transformations, paving the way for the creation of novel molecules with potential therapeutic or industrial significance. This versatility empowers chemists to push boundaries and forge new pathways in the development of chemical compounds.

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