4-((2-((2-Cyanobenzyl)thio)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl)methyl)benzoic acid CAS 688347-51-5

Purity 97%+In StockPharmaceutical Standards
CAS No.688347-51-5
Molecular FormulaC22H15N3O3S2
Molecular Weight433.50 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

4-((2-((2-Cyanobenzyl)thio)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl)methyl)benzoic acid CAS 688347-51-5 chemical structure

Description

Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.

4-((2-((2-Cyanobenzyl)thio)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl)methyl)benzoic acid (CAS 688347-51-5), molecular formula C22H15N3O3S2 and molecular weight 433.50 g/mol, is a CATO reference standard with documented purity and traceability.

Based on its molecular formula C22H15N3O3S2, 4-((2-((2-Cyanobenzyl)thio)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl)methyl)benzoic acid contains a steroid core, an amide group, a sulfone group, a hydroxyl group, an ether linkage; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 433.50 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.

CATO manufactures 4-((2-((2-Cyanobenzyl)thio)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl)methyl)benzoic acid 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 FormulaC22H15N3O3S2
Molecular Weight433.50 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
Degree of Unsaturation (DBE)17.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1985
Nitrogen Atoms3
Sulfur Atoms2

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