4-{[(4-chlorophenyl)methyl]sulfanyl}-6-[(4-fluorophenyl)sulfanyl]-11,13-dimethyl-8-thia-3,5,10-triazatricyclo[7.4.0.0^{2,7}]trideca-1(13),2(7),3,5,9,11-hexaene CAS 478065-78-0
| CAS No. | 478065-78-0 |
| Molecular Formula | C24H17ClFN3S3 |
| Molecular Weight | 498.06 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
The molecular framework of 4-{[(4-chlorophenyl)methyl]sulfanyl}-6-[(4-fluorophenyl)sulfanyl]-11,13-dimethyl-8-thia-3,5,10-triazatricyclo[7.4.0.0^{2,7}]trideca-1(13),2(7),3,5,9,11-hexaene (C24H17ClFN3S3) is characterized by a nitrogen-containing heterocyclic scaffold, a nitrile group, sulfur-containing functionality, fluorine/chlorine substitution. In reversed-phase chromatography, its retention is governed primarily by its high hydrophobicity (logP), which provides a practical basis for HPLC-UV/DAD or LC-MS method development. The presence of an aromatic ring or conjugated system gives the compound characteristic absorption bands in the UV-Vis region, making it well suited to UV or diode-array detection (DAD).
4-{[(4-chlorophenyl)methyl]sulfanyl}-6-[(4-fluorophenyl)sulfanyl]-11,13-dimethyl-8-thia-3,5,10-triazatricyclo[7.4.0.0^{2,7}]trideca-1(13),2(7),3,5,9,11-hexaene (CAS 478065-78-0), molecular formula C24H17ClFN3S3 and molecular weight 498.06 g/mol, is a CATO reference standard with documented purity and traceability.
Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.
CATO manufactures 4-{[(4-chlorophenyl)methyl]sulfanyl}-6-[(4-fluorophenyl)sulfanyl]-11,13-dimethyl-8-thia-3,5,10-triazatricyclo[7.4.0.0^{2,7}]trideca-1(13),2(7),3,5,9,11-hexaene 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 | C24H17ClFN3S3 |
| Molecular Weight | 498.06 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) | 17.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 2025 |
| Halogen Content | F/Cl-containing |
| Nitrogen Atoms | 3 |
| Sulfur Atoms | 3 |
Related chlorophenyl Standards
- 5-{[(2-chlorophenyl)methyl]sulfanyl}-3-(cyclohexylmethyl)-8,9-dimethoxy-2H,3H-imidazo[1,2-c]quinazolin-2-one (CAS 1024013-32-8)
- 5-(4-Chlorophenyl)-4-(phenylsulfonyl)-1-(2,3,4-trichlorophenyl)-1H-pyrazole (CAS 318951-62-1)
- Methyl 5-((3-chlorophenyl)carbamoyl)-2-(2,4-dichlorobenzamido)-4-methylthiophene-3-carboxylate (CAS 505096-71-9)
- 6-(4-Chlorophenyl)-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidine-2,4-diamine (CAS 23935-90-2)
- 1-[4-(4-Chlorophenyl)-1,3-thiazol-2-yl]-N-[(4-chlorophenyl)methyl]-5-(trifluoromethyl)-1H-pyrazole-4-carboxamide (CAS 321998-54-3)
- 4-(((4-Chlorophenyl)sulfonyl)methyl)-1-methyl-3-(trifluoromethyl)-5-(3-(trifluoromethyl)phenoxy)-1H-pyrazole (CAS 318959-16-9)
- Ethyl 5-(4-chlorophenyl)-2-(3,4-dimethoxybenzylidene)-7-methyl-3-oxo-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate (CAS 300377-46-2)
- (5Z)-3-(2-Chlorophenyl)-5-({2-[(4-methylphenyl)sulfanyl]-5-nitrophenyl}methylidene)-2-sulfanylidene-1,3-thiazolidin-4-one (CAS 329078-80-0)
Recommended Standards
- 5-((4-Chlorobenzyl)thio)-3-(cyclohexylmethyl)-8,9-dimethoxyimidazo[1,2-c]quinazolin-2(3H)-one (CAS 1024018-78-7)
- Bilastine impurity 134 (CAS CATO-C4X-2253134)
- 5-((3-Chlorobenzyl)thio)-3-(cyclohexylmethyl)-8,9-dimethoxyimidazo[1,2-c]quinazolin-2(3H)-one (CAS 1024017-13-7)
- Hexafluoropropene oxide trimer (CAS 2641-34-1)
- 3'-Fluoro-4'-methyl-[1,1'-biphenyl]-4-carbaldehyde (CAS 885964-50-1)
- Methyl 3-(5-methyl-1H-pyrazole-4-carboxamido)thiophene-2-carboxylate (CAS 321574-07-6)
- 9-(2-Propynyl)carbazole (CAS 4282-77-3)
- 5-(piperazin-1-ylmethyl)thiophene-2-carboxylic acid dihydrochloride (CAS 1797717-71-5)
- Hexafluorophosphoric acid solution (CAS 16940-81-1)
- Cyhalothrin Impurity 1 (CAS 76703-65-6)
- Ethyl 2-(pyridin-3-yl)thiazole-5-carboxylate (CAS 886370-75-8)
- 4-(Nonanoyloxy)benzoic acid (CAS 35179-36-3)
- Aztreonam impurity 102 (CAS CATO-C4X-1522102)
- (Cys2)-Neuropeptide Y-8-aminooctanoyl-(D-Cys27)-Neuropeptide Y (25-32) (H-3298.0500) (CAS 128806-04-2)
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