4-[6-({[(4-chlorophenyl)methyl]sulfanyl}methyl)-2-phenylpyrimidin-4-yl]morpholine CAS 338961-71-0
| CAS No. | 338961-71-0 |
| Molecular Formula | C22H22ClN3OS |
| Molecular Weight | 411.95 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
The molecular framework of 4-[6-({[(4-chlorophenyl)methyl]sulfanyl}methyl)-2-phenylpyrimidin-4-yl]morpholine (C22H22ClN3OS) is characterized by a steroid core, an amide group, sulfur-containing functionality, a hydroxyl group, an ether linkage, 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. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.
4-[6-({[(4-chlorophenyl)methyl]sulfanyl}methyl)-2-phenylpyrimidin-4-yl]morpholine (CAS 338961-71-0), molecular formula C22H22ClN3OS and molecular weight 411.95 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.
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.
Physical & Chemical Properties
| Molecular Formula | C22H22ClN3OS |
| Molecular Weight | 411.95 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 | Cl-containing |
| Nitrogen Atoms | 3 |
| Sulfur Atoms | 1 |
Related chlorophenyl Standards
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Recommended Standards
- 4-((4-Chlorobenzyl)thio)-2-phenyl-5-(piperidin-1-yl)pyridazin-3(2H)-one (CAS 5785-97-7)
- 3-(3-Chloro-4-methoxyphenyl)-4-(4-cyclohexylbenzoyl)-1-methylpyrrolidine (CAS 861211-52-1)
- 3,5-diiodo-4-(2-propynyloxy)benzaldehyde (CAS 444144-09-6)
- 2-(1-((5-Chloro-7-morpholinothiazolo[5,4-d]pyrimidin-2-yl)methyl)piperidin-4-yl)propan-2-ol (CAS 1257294-60-2)
- 2-(4-Chloro-1H-pyrazol-1-yl)-N-(4-cyanophenyl)acetamide (CAS 1178331-17-3)
- (2,5-Dimethyl-1-(4-phenoxyphenyl)-1h-pyrrol-3-yl)methanamine (CAS 1177306-77-2)
- 3-{[1,1'-Biphenyl]-4-yl}-6-(piperazin-1-yl)pyridazine (CAS 1354940-29-6)
- 5-Cyclopropoxy-3-methoxypicolinonitrile (CAS 1243466-57-0)
- 2-[(3-Chlorophenyl)sulfanyl]-N-(3-cyanothiophen-2-yl)acetamide (CAS 338777-38-1)
- 4-Methyl-6-(piperazin-1-yl)pyrimidine dihydrochloride (CAS 1365988-09-5)
- (11Z,14Z)-Ethyl icosa-11,14-dienoate (CAS 103213-62-3)
- 2-(4-(Ethoxycarbonyl)-2,5-dimethyl-1H-pyrrol-3-yl)-2-oxoethyl 2-(methylthio)nicotinate (CAS 852465-39-5)
- 1-Allyl-3-chloro-1H-1,2,4-triazole (CAS 1785763-47-4)
- Semaglutide impurity 95 (CAS CATO-C4X-222695)
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