CAS 1020719-84-9 Sulfamerazine-[d4] - Isotope / BOC Sciences

General Information
Catalog: BLP-012598
CAS: 1020719-84-9
Molecular Formula: C11H8D4N4O2S
Molecular Weight: 268.33

General Information

Catalog: BLP-012598

CAS: 1020719-84-9

Molecular Formula: C11H8D4N4O2S

Molecular Weight: 268.33

Chemical Structure

Description	Sulfamerazine-[d4] is the labelled analogue of Sulfamerazine. Sulfamerazine is a sulfonamide antibacterial.
Synonyms	Sulfamerazine-d4; 4-Amino-N-(4-methyl-2-pyrimidinyl)(benzene-d4)sulfonamide
IUPAC Name	4-amino-2,3,5,6-tetradeuterio-N-(4-methylpyrimidin-2-yl)benzenesulfonamide
Related CAS	127-79-7 (unlabelled)
Canonical SMILES	CC1=NC(=NC=C1)NS(=O)(=O)C2=CC=C(C=C2)N
InChI	InChI=1S/C11H12N4O2S/c1-8-6-7-13-11(14-8)15-18(16,17)10-4-2-9(12)3-5-10/h2-7H,12H2,1H3,(H,13,14,15)/i2D,3D,4D,5D
InChI Key	QPPBRPIAZZHUNT-QFFDRWTDSA-N
Boiling Point	519.1±52.0 °C at 760 mmHg
Melting Point	>229°C (dec.)
Purity	98% by HPLC; 98% atom D
Density	1.4±0.1 g/cm3
Solubility	Soluble in DMSO, Ethyl Acetate, Methanol
Appearance	White to Pale Beige Solid
Storage	Store at -20°C

Sulfamerazine-[d4], a deuterated variant of sulfamerazine utilized primarily in pharmacological and biochemical research, offers a myriad of applications. Here are the key applications:

Pharmacokinetics Studies: Enhancing pharmacokinetic investigations, Sulfamerazine-[d4] facilitates the monitoring of drug absorption, distribution, metabolism, and excretion within biological systems. The incorporation of deuterium atoms introduces a unique mass that can be effortlessly tracked via mass spectrometry. This distinct feature enables researchers to differentiate it from the non-deuterated form, providing precise insights into the drug's behavior within the organism.

Metabolomics Research: Within the intricate realm of metabolomics, Sulfamerazine-[d4] serves as a crucial internal standard for quantifying the levels of endogenous metabolites. By comparing the intensity of the deuterated compound with that of the metabolites, researchers attain accurate and reproducible outcomes. This application is fundamental for unraveling metabolic alterations and identifying disease biomarkers, shedding light on the complexities of biological processes.

Drug Interaction Studies: Delving into the realm of potential drug-drug interactions, Sulfamerazine-[d4] acts as a pivotal tool for investigating its influence on or by co-administered substances. Researchers can explore the effects of enzyme inhibition or induction on the metabolism of Sulfamerazine-[d4]. This information plays a crucial role in anticipating adverse reactions and optimizing combination therapies, shaping the landscape of pharmaceutical intervention.

Environmental Fate Analysis: In the vast domain of environmental science, Sulfamerazine-[d4] proves invaluable for studying the degradation and persistence of sulfamerazine in various environmental samples such as soil and water. The unique isotopic signature aids in tracking transformation products and assessing the environmental impact, contributing to the evaluation of ecological risks and the formulation of enhanced environmental management strategies.