3-(4-Allyl-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)-1-(4-chlorobenzyl)pyridin-2(1H)-one CAS 400074-99-9

Purity 97%+In StockPharmaceutical Standards
CAS No.400074-99-9
Molecular FormulaC17H15ClN4OS
Molecular Weight358.85 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

3-(4-Allyl-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)-1-(4-chlorobenzyl)pyridin-2(1H)-one CAS 400074-99-9 chemical structure

Description

This reference standard is suitable for quantitative analysis on major chromatographic platforms including HPLC, GC, LC-MS/MS, and GC-MS, serving as an external calibration standard or a system suitability test reference material.

CATO supplies 3-(4-Allyl-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)-1-(4-chlorobenzyl)pyridin-2(1H)-one (CAS 400074-99-9), a certified reference material (molecular formula C17H15ClN4OS, MW 358.85 g/mol) for analytical method development and quality control.

The molecular framework of 3-(4-Allyl-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)-1-(4-chlorobenzyl)pyridin-2(1H)-one (C17H15ClN4OS) is characterized by a steroid core, an amide group, sulfur-containing functionality, a hydroxyl group, an ether linkage, chlorine substitution. In reversed-phase chromatography, its retention is governed primarily by the protonation state of its nitrogen-containing groups, which provides a practical basis for HPLC-UV/DAD or LC-MS method development. The presence of an aromatic ring or conjugated system gives the compound characteristic absorption bands in the UV-Vis region, making it well suited to UV or diode-array detection (DAD).

CATO manufactures 3-(4-Allyl-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)-1-(4-chlorobenzyl)pyridin-2(1H)-one under ISO 17034:2016 accreditation with dual CNAS and ANAB accreditation. Each batch is characterized by orthogonal methods and supplied with a full Certificate of Analysis (COA), ensuring metrological traceability.

Physical & Chemical Properties

Molecular FormulaC17H15ClN4OS
Molecular Weight358.85 g/mol
Purity97%+
StorageStore at 2-8°C, protect from light
Solubility (reference)Soluble in DMSO, DMF, methanol
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light
Degree of Unsaturation (DBE)12.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)2025
Halogen ContentCl-containing
Nitrogen Atoms4
Sulfur Atoms1

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