N-(4-tert-Butylphenyl)-4-(2-{[(4-tert-butylphenyl)carbamothioyl]amino}ethyl)piperazine-1-carbothioamide CAS 866038-43-9

Purity 97%+In StockPharmaceutical Standards
CAS No.866038-43-9
Molecular FormulaC28H41N5S2
Molecular Weight511.79 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

N-(4-tert-Butylphenyl)-4-(2-{[(4-tert-butylphenyl)carbamothioyl]amino}ethyl)piperazine-1-carbothioamide CAS 866038-43-9 chemical structure

Description

CATO supplies N-(4-tert-Butylphenyl)-4-(2-{[(4-tert-butylphenyl)carbamothioyl]amino}ethyl)piperazine-1-carbothioamide (CAS 866038-43-9), a certified reference material (molecular formula C28H41N5S2, MW 511.79 g/mol) for analytical method development and quality control.

Structurally, N-(4-tert-Butylphenyl)-4-(2-{[(4-tert-butylphenyl)carbamothioyl]amino}ethyl)piperazine-1-carbothioamide (C28H41N5S2) contains a nitrogen-containing heterocyclic scaffold, a nitrile group, sulfur-containing functionality. The molecule exhibits a degree of unsaturation (DBE) of 11.0, corresponding to approximately 11 ring(s) or double-bond equivalent(s). With a molecular weight of 511.79 g/mol, it falls into the moderately-high-molecular-weight range. 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.

As a certified reference material (CRM), N-(4-tert-Butylphenyl)-4-(2-{[(4-tert-butylphenyl)carbamothioyl]amino}ethyl)piperazine-1-carbothioamide meets the metrological traceability requirements of ISO/IEC 17025 laboratories. Batch-to-batch consistency is monitored via control charts to guarantee comparable assigned values across lots.

Physical & Chemical Properties

Molecular FormulaC28H41N5S2
Molecular Weight511.79 g/mol
Purity97%+
StorageStore at room temperature, protect from light
Solubility (reference)Soluble in DMSO, DMF, methanol
StabilityLight-sensitive; avoid direct strong light
Degree of Unsaturation (DBE)11.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1987
Nitrogen Atoms5
Sulfur Atoms2

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