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N-Dechloroethyl Cyclophosphamide-[d4]

General Information
Catalog: BLP-004933
CAS: 1346600-68-7
Molecular Formula: C5H8D4ClN2O2P
Molecular Weight: 202.61
Chemical Structure
N-Dechloroethyl Cyclophosphamide-[d4]
Description N-Dechloroethyl Cyclophosphamide-[d4] is the labelled analogue of N-Dechloroethyl Cyclophosphamide, which is a metabolite of Cyclophosphamide.
Synonyms N-Dechloroethyl Cyclophosphamide D4; N-(2-Chloroethyl-d4)tetrahydro-2H-1,3,2-oxazaphosphorin-2-amine 2-Oxide; 2-(2-Chloroethylamino-d4)tetrahydro-2H-1,3,2-oxazaphosphorine 2-oxide; 3-Dechloroethylifosfamide-d4; Asta 4968-d4; Dechloroethylcyclophosphamide-d4; Monochloroethylcyclophosphamide-d4
IUPAC Name 2-((2-chloroethyl-1,1,2,2-d4)amino)-1,3,2-oxazaphosphinane 2-oxide
Related CAS 36761-83-8 (unlabelled)
Canonical SMILES C1CNP(=O)(OC1)NCCCl
InChI InChI=1S/C5H12ClN2O2P/c6-2-4-8-11(9)7-3-1-5-10-11/h1-5H2,(H2,7,8,9)/i2D2,4D2
InChI Key DZKGMGPLDJOVCX-BYUTVXSXSA-N
Melting Point 107-108°C
Purity 97%; ≥99% atom D
Solubility Slightly soluble in Chloroform, Methanol
Appearance White Solid
Storage Store at -20°C under inert atmosphere

N-Dechloroethyl Cyclophosphamide-[d4], a versatile compound widely utilized in pharmaceutical research and clinical pharmacokinetics, holds several key applications. Presented with high perplexity and burstiness, here are essential areas of application for this compound:

Pharmacokinetic Studies: Unraveling the complexities of drug metabolism, N-Dechloroethyl Cyclophosphamide-[d4] serves as a crucial instrument in pharmacokinetic studies, shedding light on the metabolic pathways of cyclophosphamide in the body. By meticulously tracing the drug's conversion to active metabolites using this deuterated analog, researchers gain invaluable insights for optimizing dosing regimens and understanding drug clearance mechanisms.

Quantitative Analysis: In the realm of analytical chemistry, N-Dechloroethyl Cyclophosphamide-[d4] plays a pivotal role as an internal standard for quantifying cyclophosphamide metabolites in biological samples. Its stable isotopic labeling enables precise and reliable measurement, utilizing advanced mass spectrometry techniques. This application, crucial for therapeutic drug monitoring, ensures patient safety during chemotherapy by facilitating accurate dosage adjustments.

Metabolite Profiling: In the pursuit of personalized medicine, researchers utilize N-Dechloroethyl Cyclophosphamide-[d4] to investigate the metabolite profiles of patients undergoing cyclophosphamide therapy. This exploration unveils individual variances in drug metabolism and identifies potential biomarkers for predicting treatment outcomes.

Toxicology Research: Within the domain of toxicology, N-Dechloroethyl Cyclophosphamide-[d4] emerges as a vital tool for assessing the toxic effects of cyclophosphamide and its metabolites. By scrutinizing the formation of this metabolic byproduct and its impacts on biological systems, researchers glean insights into the drug's safety profile.

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