Cas no 1023299-43-5 (1-(2-bromoethyl)-4-methyl-1H-pyrazole)
1-(2-bromoethyl)-4-methyl-1H-pyrazole Chemical and Physical Properties
Names and Identifiers
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- 1-(2-Bromoethyl)-4-methyl-1H-pyrazole
- 1H-Pyrazole, 1-(2-bromoethyl)-4-methyl-
- 1-(2-bromoethyl)-4-methyl-1H-pyrazole
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- MDL: MFCD12800644
- Inchi: 1S/C6H9BrN2/c1-6-4-8-9(5-6)3-2-7/h4-5H,2-3H2,1H3
- InChI Key: ZNVBHEBIDPKSAE-UHFFFAOYSA-N
- SMILES: N1(CCBr)C=C(C)C=N1
Computed Properties
- Exact Mass: 187.99491g/mol
- Monoisotopic Mass: 187.99491g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 9
- Rotatable Bond Count: 2
- Complexity: 87.1
- 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
- Molecular Weight: 189.05g/mol
- XLogP3: 1.3
- Topological Polar Surface Area: 17.8?2
1-(2-bromoethyl)-4-methyl-1H-pyrazole Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Chemenu | CM330857-100mg |
1-(2-Bromoethyl)-4-methyl-1H-pyrazole |
1023299-43-5 | 95%+ | 100mg |
$489 | 2021-08-18 | |
| Chemenu | CM330857-250mg |
1-(2-Bromoethyl)-4-methyl-1H-pyrazole |
1023299-43-5 | 95%+ | 250mg |
$587 | 2021-08-18 | |
| Chemenu | CM330857-1g |
1-(2-Bromoethyl)-4-methyl-1H-pyrazole |
1023299-43-5 | 95%+ | 1g |
$1976 | 2021-08-18 | |
| TRC | B998393-10mg |
1-(2-Bromoethyl)-4-methyl-1H-pyrazole |
1023299-43-5 | 10mg |
$ 50.00 | 2022-06-06 | ||
| TRC | B998393-50mg |
1-(2-Bromoethyl)-4-methyl-1H-pyrazole |
1023299-43-5 | 50mg |
$ 185.00 | 2022-06-06 | ||
| TRC | B998393-100mg |
1-(2-Bromoethyl)-4-methyl-1H-pyrazole |
1023299-43-5 | 100mg |
$ 295.00 | 2022-06-06 | ||
| Chemenu | CM330857-100mg |
1-(2-Bromoethyl)-4-methyl-1H-pyrazole |
1023299-43-5 | 95%+ | 100mg |
$301 | 2023-02-03 | |
| Chemenu | CM330857-250mg |
1-(2-Bromoethyl)-4-methyl-1H-pyrazole |
1023299-43-5 | 95%+ | 250mg |
$451 | 2023-02-03 | |
| Chemenu | CM330857-1g |
1-(2-Bromoethyl)-4-methyl-1H-pyrazole |
1023299-43-5 | 95%+ | 1g |
$1303 | 2023-02-03 | |
| 1PlusChem | 1P01BA84-50mg |
1-(2-bromoethyl)-4-methyl-1H-pyrazole |
1023299-43-5 | 95% | 50mg |
$275.00 | 2023-12-27 |
1-(2-bromoethyl)-4-methyl-1H-pyrazole Related Literature
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Hailing Chen,Lu Yin,Meng Liu,Laibing Wang,Michiya Fujiki,Wei Zhang RSC Adv., 2019,9, 4849-4856
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Tanya Ostapenko,Peter J. Collings,Samuel N. Sprunt,J. T. Gleeson Soft Matter, 2013,9, 9487-9498
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Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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Dhamodaran Manikandan,S. Amirthapandian,I. S. Zhidkov,A. I. Kukharenko,S. O. Cholakh,Ramaswamy Murugan Phys. Chem. Chem. Phys., 2018,20, 6500-6514
Additional information on 1-(2-bromoethyl)-4-methyl-1H-pyrazole
Recent Advances in the Study of 1-(2-bromoethyl)-4-methyl-1H-pyrazole (CAS: 1023299-43-5) in Chemical Biology and Pharmaceutical Research
1-(2-bromoethyl)-4-methyl-1H-pyrazole (CAS: 1023299-43-5) is a pyrazole derivative that has garnered significant attention in recent years due to its potential applications in medicinal chemistry and drug discovery. This compound serves as a versatile intermediate in the synthesis of biologically active molecules, particularly in the development of kinase inhibitors and other therapeutic agents. Recent studies have explored its reactivity, pharmacological properties, and utility in targeted drug design, making it a compound of interest for researchers in the field.
One of the key areas of research involving 1-(2-bromoethyl)-4-methyl-1H-pyrazole is its role as a building block for the synthesis of kinase inhibitors. Kinases are critical targets in cancer therapy, and the ability to modify the pyrazole core with various substituents allows for the creation of compounds with enhanced selectivity and potency. Recent publications have highlighted its use in the development of novel inhibitors targeting specific kinases, such as JAK2 and CDK4/6, which are implicated in various malignancies.
In addition to its applications in kinase inhibitor development, 1-(2-bromoethyl)-4-methyl-1H-pyrazole has been investigated for its potential in other therapeutic areas. For example, researchers have explored its incorporation into small molecules designed to modulate GPCRs (G-protein-coupled receptors) and ion channels, which are important targets for neurological and cardiovascular diseases. The bromoethyl moiety of the compound provides a handle for further functionalization, enabling the attachment of diverse pharmacophores to optimize drug-like properties.
Recent synthetic methodologies have also focused on improving the efficiency and scalability of producing 1-(2-bromoethyl)-4-methyl-1H-pyrazole. Advances in catalysis and green chemistry have led to more sustainable routes for its synthesis, reducing the environmental impact and cost associated with large-scale production. These developments are particularly relevant for pharmaceutical companies looking to incorporate this intermediate into their drug discovery pipelines.
Despite its promising applications, challenges remain in the use of 1-(2-bromoethyl)-4-methyl-1H-pyrazole. Issues such as stability under physiological conditions and potential off-target effects need to be addressed through further research. However, ongoing studies are leveraging computational modeling and high-throughput screening to optimize its derivatives for improved pharmacokinetic and safety profiles.
In conclusion, 1-(2-bromoethyl)-4-methyl-1H-pyrazole (CAS: 1023299-43-5) represents a valuable tool in the toolkit of medicinal chemists. Its versatility and potential for modification make it a key intermediate in the development of next-generation therapeutics. As research continues to uncover new applications and refine synthetic approaches, this compound is poised to play an increasingly important role in chemical biology and pharmaceutical innovation.
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