(4,6-Dimethylpyrimidin-5-yl)(4-((S)-4-((1R,2R)-2-ethoxy-5-(trifluoromethyl)-2,3-dihydro-1H-inden-1-yl)-3-methylpiperazin-1-yl)-4-methylpiperidin-1-yl)methanone CAS 869769-98-2
| CAS No. | 869769-98-2 |
| Molecular Formula | C30H40F3N5O2 |
| Molecular Weight | 559.67 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
The assigned purity is verified by mass-balance and quantitative NMR (qNMR) approaches, with the expanded uncertainty reported at a 95% confidence level (k=2). Batch homogeneity and stability are independently assessed for every lot.
CATO supplies (4,6-Dimethylpyrimidin-5-yl)(4-((S)-4-((1R,2R)-2-ethoxy-5-(trifluoromethyl)-2,3-dihydro-1H-inden-1-yl)-3-methylpiperazin-1-yl)-4-methylpiperidin-1-yl)methanone (CAS 869769-98-2), a certified reference material (molecular formula C30H40F3N5O2, MW 559.67 g/mol) for analytical method development and quality control.
Owing to a steroid core, an amide group, a hydroxyl group, an ether linkage, fluorine substitution, (4,6-Dimethylpyrimidin-5-yl)(4-((S)-4-((1R,2R)-2-ethoxy-5-(trifluoromethyl)-2,3-dihydro-1H-inden-1-yl)-3-methylpiperazin-1-yl)-4-methylpiperidin-1-yl)methanone is typically pale yellow to yellow crystalline powder. Its solid-state physicochemical attributes — including a molecular weight of 559.67 g/mol — guide the selection of appropriate sample preparation and analytical techniques. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.
Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.
Physical & Chemical Properties
| Molecular Formula | C30H40F3N5O2 |
| Molecular Weight | 559.67 g/mol |
| Appearance | Pale yellow to yellow crystalline powder. (slight halide-like odor, low volatility) |
| 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) | 12.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1987 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 5 |
Related Dimethylpyrimidin Standards
- 2-((4,6-Dimethylpyrimidin-2-yl)thio)-N-(5-(3-((1-(2-methoxyethyl)-1H-1,2,3-triazol-4-yl)methoxy)benzyl)thiazol-2-yl)acetamide (CAS 1862238-01-4)
- 2-((5-(((4,6-Dimethylpyrimidin-2-yl)thio)methyl)-1,3,4-oxadiazol-2-yl)thio)-N-(4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)acetamide (CAS 335397-59-6)
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- 6-(((4,6-Dimethylpyrimidin-2-yl)thio)methyl)-4-oxo-4H-pyran-3-yl 4-(trifluoromethyl)benzoate (CAS 877636-68-5)
- N-(2,6-dimethylpyrimidin-4-yl)-4-(((3-hydroxy-1-oxo-1H-inden-2-yl)methylene)amino)benzenesulfonamide (CAS 1024128-19-5)
- Ethyl 2-(2-(2-(2-((4,6-dimethylpyrimidin-2-yl)amino)thiazol-4-yl)acetamido)thiazol-4-yl)acetate (CAS 1226445-31-3)
- 2-(2-((4,6-Dimethylpyrimidin-2-yl)amino)thiazol-4-yl)-1-(4-(furan-2-carbonyl)piperazin-1-yl)ethan-1-one (CAS 1226428-66-5)
- 2-((4-(N-(4,6-dimethylpyrimidin-2-yl)sulfamoyl)phenyl)carbamoyl)benzoic acid (CAS 94134-30-2)
Recommended Standards
- Phenylac-Leu-Asp-Phe-D-Pro-NH2 (H-3376.0005) (CAS 209601-16-1)
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- Cholesteryl (CAS 32832-01-2)
- m-PEG12-amine (CAS 1977493-48-3)
- {1-[(3-Methoxyphenyl)methyl]cyclobutyl}methanamine hydrochloride (CAS 1439899-58-7)
- 1-(4-(Dimethylamino)phenyl)-n1,n1-dimethylethane-1,2-diamine (CAS 927976-70-3)
- (3,5-Dichlorophenyl)(3,4-dimethylphenyl)methanone (CAS 951884-27-8)
- N-[3-(aminomethyl)pyridin-2-yl]-N-methylmethanesulfonamide (CAS 939791-42-1)
- Methyl (2S,4S)-4-(4-chloro-2-ethylphenoxy)-2-pyrrolidinecarboxylate hydrochloride (CAS 1354488-02-0)
- 1-((2-(Trimethylsilyl)ethoxy)methyl)-1H-benzo[d]imidazole (CAS 101226-37-3)
- (S)-tert-Butyl 4-((2-amino-N,3-dimethylbutanamido)methyl)piperidine-1-carboxylate (CAS 1353993-92-6)
- Methyl 5-((3-chlorophenyl)carbamoyl)-2-((5,6-dimethyl-2H-pyran-2-yl)(ethoxy)amino)-4-methylthiophene-3-carboxylate (CAS 505096-40-2)
- 1,4-dichloro-2,5-dinitrobenzene (CAS 17488-24-4)
- Palmitoyl Tripeptide-5 TFA (CAS 623172-55-4（free base）)
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