3-(5-((3-Fluorobenzyl)thio)-4-hexyl-4H-1,2,4-triazol-3-yl)-1H-indole CAS 568560-96-3

Purity 97%+In StockPharmaceutical Standards
CAS No.568560-96-3
Molecular FormulaC23H25FN4S
Molecular Weight408.53 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

3-(5-((3-Fluorobenzyl)thio)-4-hexyl-4H-1,2,4-triazol-3-yl)-1H-indole CAS 568560-96-3 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.

3-(5-((3-Fluorobenzyl)thio)-4-hexyl-4H-1,2,4-triazol-3-yl)-1H-indole (CAS 568560-96-3), molecular formula C23H25FN4S and molecular weight 408.53 g/mol, is a CATO reference standard with documented purity and traceability.

Structurally, 3-(5-((3-Fluorobenzyl)thio)-4-hexyl-4H-1,2,4-triazol-3-yl)-1H-indole (C23H25FN4S) contains a nitrogen-containing heterocyclic scaffold, a nitrile group, sulfur-containing functionality, fluorine substitution. The molecule exhibits a degree of unsaturation (DBE) of 13.0, corresponding to approximately 13 ring(s) or double-bond equivalent(s). With a molecular weight of 408.53 g/mol, it falls into the moderately-high-molecular-weight range. The high carbon-to-hydrogen ratio imparts good lipophilicity, allowing liquid-liquid extraction with non-polar solvents such as n-hexane or ethyl acetate.

As a certified reference material (CRM), 3-(5-((3-Fluorobenzyl)thio)-4-hexyl-4H-1,2,4-triazol-3-yl)-1H-indole 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 FormulaC23H25FN4S
Molecular Weight408.53 g/mol
Purity97%+
StorageStore at room temperature, 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)13.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1984
Halogen ContentF-containing
Nitrogen Atoms4
Sulfur Atoms1

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