2-((5-(4-Chlorophenyl)-4-((tetrahydrofuran-2-yl)methyl)-4H-1,2,4-triazol-3-yl)thio)-N-(2-cyano-3-methylbutan-2-yl)acetamide CAS 763095-04-1
| CAS No. | 763095-04-1 |
| Molecular Formula | C21H26ClN5O2S |
| Molecular Weight | 447.98 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Compared with other compounds in its class, the molecular weight of 447.98 g/mol gives 2-((5-(4-Chlorophenyl)-4-((tetrahydrofuran-2-yl)methyl)-4H-1,2,4-triazol-3-yl)thio)-N-(2-cyano-3-methylbutan-2-yl)acetamide distinctive chromatographic separation conditions and mass-spectrometry parameter settings.
CATO supplies 2-((5-(4-Chlorophenyl)-4-((tetrahydrofuran-2-yl)methyl)-4H-1,2,4-triazol-3-yl)thio)-N-(2-cyano-3-methylbutan-2-yl)acetamide (CAS 763095-04-1), a certified reference material (molecular formula C21H26ClN5O2S, MW 447.98 g/mol) for analytical method development and quality control.
Owing to a steroid core, an amide group, a sulfone group, a hydroxyl group, an ether linkage, chlorine substitution, 2-((5-(4-Chlorophenyl)-4-((tetrahydrofuran-2-yl)methyl)-4H-1,2,4-triazol-3-yl)thio)-N-(2-cyano-3-methylbutan-2-yl)acetamide is typically pale yellow to yellow crystalline powder. Its solid-state physicochemical attributes — including a molecular weight of 447.98 g/mol — guide the selection of appropriate sample preparation and analytical techniques. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.
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 2-((5-(4-Chlorophenyl)-4-((tetrahydrofuran-2-yl)methyl)-4H-1,2,4-triazol-3-yl)thio)-N-(2-cyano-3-methylbutan-2-yl)acetamide 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 Formula | C21H26ClN5O2S |
| Molecular Weight | 447.98 g/mol |
| Purity | 97%+ |
| Storage | Store in a cool place (≤25°C), protect from light, keep sealed and dry |
| Solubility (reference) | Soluble in DMSO, DMF, methanol |
| Stability | May 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) | 11.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1986 |
| Halogen Content | Cl-containing |
| Nitrogen Atoms | 5 |
| Sulfur Atoms | 1 |
Related Chlorophenyl Standards
- (E)-({5-[(4-chlorophenyl)sulfanyl]-1-methyl-3-phenyl-1H-pyrazol-4-yl}methylidene)[(4-methylphenyl)methoxy]amine (CAS 321998-29-2)
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- 1-(4-Chlorophenyl)-3-methyl-n-(3-methyl-1-phenyl-1h-pyrazol-5-yl)-1h-thieno[2,3-c]pyrazole-5-carboxamide (CAS 380238-17-5)
- 2-(((4-(4-Chlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl)thio)methyl)-1H-benzo[d]imidazole (CAS 618880-66-3)
- 2'-(4-(4-Chlorophenyl)thiazol-2-yl)-5,5'-dimethyl-2-phenyl-1',2'-dihydro-2H,3'H-[3,4'-bipyrazol]-3'-one (CAS 318949-54-1)
- 6-{[(2-chlorophenyl)methyl]sulfanyl}-4,5,7,9,13-pentaazapentacyclo[11.8.0.0^{3,11}.0^{4,8}.0^{16,21}]henicosa-3(11),5,7,9,16(21),17,19-heptaen-12-one (CAS 344262-83-5)
- 6-{[(3-chlorophenyl)methyl]sulfanyl}-4,5,7,9,13-pentaazapentacyclo[11.8.0.0^{3,11}.0^{4,8}.0^{16,21}]henicosa-3(11),5,7,9,16(21),17,19-heptaen-12-one (CAS 344262-91-5)
- 5-(2-Chlorophenyl)-3-(4-(dimethylamino)phenyl)-2-phenyltetrahydro-4H-pyrrolo[3,4-d]isoxazole-4,6(5H)-dione (CAS 308101-49-7)
Recommended Standards
- 2-Chloro-5-({2-[3-(2,5-dimethyl-1H-pyrrol-1-yl)thiophen-2-yl]-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl}methyl)pyridine (CAS 866040-64-4)
- (R)-tert-butyl 3-((R)-(3-chlorophenyl)(2-(methylsulfonyloxy)ethoxy)methyl)piperidine-1-carboxylate (CAS 942145-04-2)
- 4,4'-Dibromo-2,2'-bis(trifluoromethyl)-1,1'-biphenyl (CAS 176714-72-0)
- 2-(3-Chloro-4-((3-((3-ethyl-7-propylbenzo[d]isoxazol-6-yl)oxy)propyl)thio)phenyl)acetic acid (CAS 194608-76-9)
- [7-fluoro-8-(2-triisopropylsilylethynyl)-1-naphthyl]boronic acid (CAS 2763158-66-1)
- 5-Chloro-2-(2-(2-((3-(furan-3-yl)phenyl)amino)-2-oxoethoxy)acetamido)benzoic acid (CAS 1190221-43-2)
- 2-Benzylpyrimidine (CAS 90210-57-4)
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- Tert-butyl (R)-2-(hydroxymethyl)-3,3-dimethylazetidine-1-carboxylate (CAS 228868-39-1)
- Ethyl 1-{[4-(tert-butyl)phenyl]sulfonyl}-3,5-dimethyl-1H-pyrazole-4-carboxylate (CAS 956930-20-4)
- 1-benzyl 4-tert-butyl 6-oxo-1,4-diazepane-1,4-dicarboxylate (CAS 1273566-12-3)
- 4-[4-(azetidin-3-yl)piperazin-1-yl]-3-chlorobenzonitrile (CAS 1493479-16-5)
- Peptide YY (3-36) (human) (CAS 123583-37-9)
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