3-(Azepan-1-ylsulfonyl)-4-chloro-N-(4H-1,2,4-triazol-3-yl)benzamide CAS 521282-12-2

Purity 97%+In StockPharmaceutical Standards
CAS No.521282-12-2
Molecular FormulaC15H18ClN5O3S
Molecular Weight383.85 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

3-(Azepan-1-ylsulfonyl)-4-chloro-N-(4H-1,2,4-triazol-3-yl)benzamide CAS 521282-12-2 chemical structure

Description

The occurrence of 3-(Azepan-1-ylsulfonyl)-4-chloro-N-(4H-1,2,4-triazol-3-yl)benzamide is closely related to a nitrogen-containing heterocyclic scaffold, an amide group, a sulfone group, a hydroxyl group, an ether linkage, chlorine substitution in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.

3-(Azepan-1-ylsulfonyl)-4-chloro-N-(4H-1,2,4-triazol-3-yl)benzamide (CAS 521282-12-2) is a high-purity analytical reference standard with the molecular formula C15H18ClN5O3S and a molecular weight of 383.85 g/mol.

The molecular framework of 3-(Azepan-1-ylsulfonyl)-4-chloro-N-(4H-1,2,4-triazol-3-yl)benzamide (C15H18ClN5O3S) is characterized by a nitrogen-containing heterocyclic scaffold, an amide group, a sulfone group, 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. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.

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.

The assigned purity is verified by mass-balance and quantitative NMR (qNMR) approaches, with the expanded uncertainty reported at a 95% confidence level (k=2). Batch homogeneity and stability are independently assessed for every lot.

Physical & Chemical Properties

Molecular FormulaC15H18ClN5O3S
Molecular Weight383.85 g/mol
Purity97%+
StorageStore at 2-8°C, protect from light, keep sealed and dry
Solubility (reference)Soluble in DMSO, DMF, methanol
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light; Hygroscopic; reseal immediately after opening; Contains ester bond; hydrolyzes under strong alkaline conditions
Degree of Unsaturation (DBE)9.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1984
Halogen ContentCl-containing
Nitrogen Atoms5
Sulfur Atoms1

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