1-(3,5-bis(trifluoromethyl)phenyl)-3-((1R)-quinolin-4-yl((1S,4S,5R)-5-vinylquinuclidin-2-yl)methyl)urea CAS 945985-98-8

Purity 97%+In StockPharmaceutical Standards
CAS No.945985-98-8
Molecular FormulaC28H26F6N4O
Molecular Weight548.52 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

1-(3,5-bis(trifluoromethyl)phenyl)-3-((1R)-quinolin-4-yl((1S,4S,5R)-5-vinylquinuclidin-2-yl)methyl)urea CAS 945985-98-8 chemical structure

Description

Structurally, 1-(3,5-bis(trifluoromethyl)phenyl)-3-((1R)-quinolin-4-yl((1S,4S,5R)-5-vinylquinuclidin-2-yl)methyl)urea (C28H26F6N4O) contains a steroid core, an amide group, a hydroxyl group, an ether linkage, fluorine substitution. The molecule exhibits a degree of unsaturation (DBE) of 15.0, corresponding to approximately 15 ring(s) or double-bond equivalent(s). With a molecular weight of 548.52 g/mol, it falls into the moderately-high-molecular-weight range. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.

CATO supplies 1-(3,5-bis(trifluoromethyl)phenyl)-3-((1R)-quinolin-4-yl((1S,4S,5R)-5-vinylquinuclidin-2-yl)methyl)urea (CAS 945985-98-8), a certified reference material (molecular formula C28H26F6N4O, MW 548.52 g/mol) for analytical method development and quality control.

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.

CATO manufactures 1-(3,5-bis(trifluoromethyl)phenyl)-3-((1R)-quinolin-4-yl((1S,4S,5R)-5-vinylquinuclidin-2-yl)methyl)urea 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 FormulaC28H26F6N4O
Molecular Weight548.52 g/mol
AppearancePale yellow to yellow crystalline powder. (slight halide-like odor, low volatility)
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)15.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1987
Halogen ContentF-containing
Nitrogen Atoms4

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