5-(5-(Allylthio)-4-phenyl-4H-1,2,4-triazol-3-yl)-1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazole CAS 338414-87-2
| CAS No. | 338414-87-2 |
| Molecular Formula | C18H14F3N5S2 |
| Molecular Weight | 421.46 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Under current pharmacopoeial and regulatory frameworks, quality-control requirements for this class of reference material explicitly involve the control of targets including 5-(5-(Allylthio)-4-phenyl-4H-1,2,4-triazol-3-yl)-1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazole.
5-(5-(Allylthio)-4-phenyl-4H-1,2,4-triazol-3-yl)-1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazole (CAS 338414-87-2), molecular formula C18H14F3N5S2 and molecular weight 421.46 g/mol, is a CATO reference standard with documented purity and traceability.
The molecular framework of 5-(5-(Allylthio)-4-phenyl-4H-1,2,4-triazol-3-yl)-1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazole (C18H14F3N5S2) is characterized by a nitrogen-containing heterocyclic scaffold, a nitrile group, sulfur-containing functionality, fluorine substitution. In reversed-phase chromatography, its retention is governed primarily by the protonation state of its nitrogen-containing groups, which provides a practical basis for HPLC-UV/DAD or LC-MS method development. 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.
CATO manufactures 5-(5-(Allylthio)-4-phenyl-4H-1,2,4-triazol-3-yl)-1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazole 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 | C18H14F3N5S2 |
| Molecular Weight | 421.46 g/mol |
| Purity | 97%+ |
| Storage | Store at room temperature, protect from light |
| Solubility (reference) | Soluble in DMSO, DMF, methanol |
| Stability | May oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light |
| Degree of Unsaturation (DBE) | 13.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 2025 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 5 |
| Sulfur Atoms | 2 |
Related Allylthio Standards
- 3-(5-(Allylthio)-4-ethyl-4H-1,2,4-triazol-3-yl)-1-(2,4-dichlorobenzyl)pyridin-2(1H)-one (CAS 477853-23-9)
- 4-(5-(Allylthio)-4-ethyl-4H-1,2,4-triazol-3-yl)-1-((4-methoxyphenyl)sulfonyl)piperidine (CAS 383148-32-1)
- Methyl 2-((2-(allylthio)benzo[4,5]thieno[3,2-d]pyrimidin-4-yl)thio)benzoate (CAS 478030-03-4)
- 2-(1-(5-(Allylthio)-4-phenyl-4H-1,2,4-triazol-3-yl)ethyl)-3-chloro-5-(trifluoromethyl)pyridine (CAS 339010-61-6)
- 2-(Allylthio)-4-((3-methoxyphenyl)thio)-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d]pyrimidine (CAS 672950-77-5)
- 2-(Allylthio)-4-((4-chlorophenyl)thio)-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d]pyrimidine (CAS 672950-76-4)
- (E)-2-(allylthio)-1-benzyl-1H-imidazole-5-carbaldehyde O-(2,4-dichlorobenzyl) oxime (CAS 320423-18-5)
- 5,5'-Bis(allylthio)-4,4'-diphenyl-4H,4'H-3,3'-bi(1,2,4-triazole) (CAS 63776-97-6)
Recommended Standards
- {6,7-Dimethoxy-2-[(4-methoxyphenyl)sulfonyl]-1,2,3,4-tetrahydroisoquinolin-1-yl}acetic acid (CAS 932539-69-0)
- 8-Methyl-N-(4-(trifluoromethoxy)phenyl)-4H-thieno[3,2-c]thiochromene-2-carboxamide (CAS 477887-29-9)
- Methyl (2Z)-3-[(3,4-dimethoxyphenyl)amino]-2-(4-ethoxybenzenesulfonyl)prop-2-enoate (CAS 1327184-25-7)
- Diethyl 5-(3,4-dimethoxybenzamido)-3-methylthiophene-2,4-dicarboxylate (CAS 5657-82-9)
- Omarigliptin Impurity 4 (CAS 1226781-87-8)
- (S)-2-(4-(2-((2-hydroxy-3-(2-(thiophen-2-yl)phenoxy)propyl)amino)-2-methylpropyl)phenoxy)nicotinonitrile hemifumarate (CAS 391926-19-5)
- (5-Methylpyridin-2-yl)(4-(trifluoromethyl)phenyl)methanone (CAS 1187166-46-6)
- (6-Amino-[3,4'-bipyridin]-5-yl)methanol (CAS 1804288-72-9)
- 8-Bromo-6-chloro-2-methylpyrido[3,4-d]pyrimidin-4(1H)-one (CAS 2738394-22-2)
- (3-Bromo-2,5,6-trifluorophenyl)methanamine 2,2,2-trifluoroacetate (CAS 1956377-81-3)
- 4-(1-Phenoxyethyl)thiazol-2-amine (CAS 915921-97-0)
- (S)-2-amino-1-(isoindolin-2-yl)-3-methylbutan-1-one (CAS 1822065-66-6)
- 1-(3-Methyl-1,1-dioxidotetrahydrothiophen-3-yl)urea (CAS 302581-27-7)
- Glu17-Semaglutide (CAS CATO-C4X-2226209)
Why CATO?
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