1-(4-Bromophenyl)-5-(furan-2-ylmethylene)-3-phenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione CAS 414908-02-4

Purity 97%+In StockPharmaceutical Standards
CAS No.414908-02-4
Molecular FormulaC21H13BrN2O3S
Molecular Weight453.31 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

1-(4-Bromophenyl)-5-(furan-2-ylmethylene)-3-phenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione CAS 414908-02-4 chemical structure

Description

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.

CATO supplies 1-(4-Bromophenyl)-5-(furan-2-ylmethylene)-3-phenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione (CAS 414908-02-4), a certified reference material (molecular formula C21H13BrN2O3S, MW 453.31 g/mol) for analytical method development and quality control.

Structurally, 1-(4-Bromophenyl)-5-(furan-2-ylmethylene)-3-phenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione (C21H13BrN2O3S) contains a steroid core, an amide group, a sulfone group, a hydroxyl group, an ether linkage, bromine substitution. The molecule exhibits a degree of unsaturation (DBE) of 16.0, corresponding to approximately 16 ring(s) or double-bond equivalent(s). With a molecular weight of 453.31 g/mol, it falls into the moderately-high-molecular-weight range. The aromatic system may exhibit native fluorescence, enabling detection with a fluorescence detector (FLD).

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.

Physical & Chemical Properties

Molecular FormulaC21H13BrN2O3S
Molecular Weight453.31 g/mol
Purity97%+
StorageStore in a cool place (≤25°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)16.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)2025
Halogen ContentBr-containing
Nitrogen Atoms2
Sulfur Atoms1

Related Bromophenyl Standards

Recommended Standards

Why CATO?