Cas no 339016-21-6 (4-[6-Chloro-2-(methylsulfanyl)-4-pyrimidinyl]morpholine)
4-[6-Chloro-2-(methylsulfanyl)-4-pyrimidinyl]morpholine Chemical and Physical Properties
Names and Identifiers
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- 4-CHLORO-6-MORPHOLINO-2-PYRIMIDINYL METHYL SULFIDE
- 4-chloro-2-(methyltio)-6-morpholinopyrimidine
- 4-(6-chloro-2-(methylthio)pyrimidin-4-yl)morpholine
- 4-[6-chloro-2-(methylsulfanyl)pyrimidin-4-yl]morpholine
- 4-[6-chloro-2-(methylsulfanyl)-4-pyrimidinyl]morpholine
- Oprea1_685409
- MLS000720897
- MGDCTXYEVAWARZ-UHFFFAOYSA-N
- HMS2632M08
- SBB100054
- SMR000334254
- 4-chloro-2-methylthio-6-morpholin-4-ylpyrimidine
- 4-(6-chloro-2-methylsulfanyl-pyrimidin-4-yl)-morpholine
- 4-[6-Chloro-2-(methylsulfanyl)-4-pyrimidinyl]morpholine
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- MDL: MFCD00664702
- Inchi: 1S/C9H12ClN3OS/c1-15-9-11-7(10)6-8(12-9)13-2-4-14-5-3-13/h6H,2-5H2,1H3
- InChI Key: MGDCTXYEVAWARZ-UHFFFAOYSA-N
- SMILES: ClC1=CC(=NC(=N1)SC)N1CCOCC1
Computed Properties
- Exact Mass: 245.039
- Monoisotopic Mass: 245.039
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 204
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 63.6
Experimental Properties
- Density: 1.38
- Boiling Point: 413.8 °C at 760 mmHg
- Flash Point: 204.1 °C
4-[6-Chloro-2-(methylsulfanyl)-4-pyrimidinyl]morpholine Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| abcr | AB297799-100 mg |
4-[6-Chloro-2-(methylsulfanyl)-4-pyrimidinyl]morpholine; . |
339016-21-6 | 100 mg |
€221.50 | 2023-07-20 | ||
| abcr | AB297799-100mg |
4-[6-Chloro-2-(methylsulfanyl)-4-pyrimidinyl]morpholine; . |
339016-21-6 | 100mg |
€283.50 | 2025-02-16 | ||
| Ambeed | A930843-1g |
4-[6-Chloro-2-(methylsulfanyl)pyrimidin-4-yl]morpholine |
339016-21-6 | 90% | 1g |
$350.0 | 2024-04-19 | |
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1622863-1mg |
4-(6-Chloro-2-(methylthio)pyrimidin-4-yl)morpholine |
339016-21-6 | 98% | 1mg |
¥428.00 | 2024-05-18 | |
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1622863-2mg |
4-(6-Chloro-2-(methylthio)pyrimidin-4-yl)morpholine |
339016-21-6 | 98% | 2mg |
¥495.00 | 2024-05-18 | |
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1622863-5mg |
4-(6-Chloro-2-(methylthio)pyrimidin-4-yl)morpholine |
339016-21-6 | 98% | 5mg |
¥617.00 | 2024-05-18 | |
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1622863-10mg |
4-(6-Chloro-2-(methylthio)pyrimidin-4-yl)morpholine |
339016-21-6 | 98% | 10mg |
¥862.00 | 2024-05-18 |
4-[6-Chloro-2-(methylsulfanyl)-4-pyrimidinyl]morpholine Related Literature
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
Additional information on 4-[6-Chloro-2-(methylsulfanyl)-4-pyrimidinyl]morpholine
4-[6-Chloro-2-(methylsulfanyl)-4-pyrimidinyl]Morpholine: A Comprehensive Overview
The compound CAS No. 339016-21-6, also known as 4-[6-Chloro-2-(methylsulfanyl)-4-pyrimidinyl]Morpholine, is a highly specialized chemical entity that has garnered significant attention in the fields of organic chemistry, pharmacology, and materials science. This compound is notable for its unique structural features and potential applications in drug development and advanced materials. In this article, we will delve into its chemical properties, synthesis methods, biological activities, and the latest research findings that highlight its significance in contemporary scientific exploration.
Chemical Structure and Synthesis
The molecular structure of 4-[6-Chloro-2-(methylsulfanyl)-4-pyrimidinyl]Morpholine is characterized by a pyrimidine ring system fused with a morpholine moiety. The pyrimidine ring contains a chlorine substituent at position 6 and a methylsulfanyl group at position 2, which contribute to its unique electronic and steric properties. The morpholine ring, on the other hand, introduces flexibility and hydrogen bonding capabilities, making this compound versatile for various applications.
The synthesis of this compound typically involves multi-step reactions, including nucleophilic substitutions, condensations, and oxidations. Recent advancements in catalytic methods have enabled more efficient and selective syntheses, reducing production costs and improving yields. Researchers have also explored green chemistry approaches to minimize environmental impact during the synthesis process.
Biological Activity and Pharmacological Properties
4-[6-Chloro-2-(methylsulfanyl)-4-pyrimidinyl]Morpholine has demonstrated promising biological activity in preclinical studies. It exhibits potent inhibitory effects on key enzymes involved in inflammatory pathways, making it a potential candidate for anti-inflammatory drug development. Additionally, studies have shown its ability to modulate ion channels, which could be beneficial in treating neurological disorders such as epilepsy and chronic pain.
Recent research has also highlighted its potential as an anticancer agent. In vitro experiments have revealed that this compound induces apoptosis in various cancer cell lines by targeting specific oncogenic pathways. Furthermore, its ability to cross the blood-brain barrier suggests promising applications in neuro-oncology.
Applications in Materials Science
Beyond its pharmacological applications, CAS No. 339016-21-6 has found utility in materials science due to its unique electronic properties. Its pyrimidine core exhibits strong UV absorption characteristics, making it a valuable component in advanced optical materials and sensors. Researchers have explored its use in developing high-efficiency organic photovoltaic devices, where it serves as an electron transport layer material.
In addition, the compound's morpholine moiety contributes to its amphiphilic nature, enabling self-assembling properties that are advantageous in nanotechnology applications. Recent studies have demonstrated its potential as a building block for constructing supramolecular assemblies with tailored functionalities.
Safety and Environmental Considerations
As with any chemical compound, understanding the safety profile of 4-[6-Chloro-2-(methylsulfanyl)-4-pyrimidinyl]Morpholine is crucial for its responsible use. Acute toxicity studies indicate that it has a relatively low toxicity profile when administered at therapeutic doses. However, chronic exposure studies are still underway to fully assess long-term effects.
Future Directions and Research Opportunities
The future of CAS No. 339016-21-6 lies in exploring new frontiers of application and improving existing technologies. Collaborative efforts between chemists, biologists, and materials scientists are expected to unlock novel uses for this compound across diverse industries.
Potential research directions include:- Investigating novel synthetic pathways for enhanced scalability;- Exploring combinatorial chemistry approaches to develop derivative compounds with improved bioavailability;- Expanding its application scope in advanced materials such as flexible electronics;- Conducting comprehensive clinical trials to validate its therapeutic efficacy;- Developing sustainable manufacturing practices aligned with green chemistry principles.
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