Cas no 1415800-40-6 (methyl 5-methoxypyrimidine-2-carboxylate)
methyl 5-methoxypyrimidine-2-carboxylate Chemical and Physical Properties
Names and Identifiers
-
- methyl 5-methoxypyrimidine-2-carboxylate
- BS-42843
- CS-0184791
- 1415800-40-6
- DB-221193
- SB12716
- BP-21089
- IXSNCJLZKACDOD-UHFFFAOYSA-N
- SCHEMBL15264511
- F52806
- SY129042
- methyl5-methoxypyrimidine-2-carboxylate
- MFCD22683287
-
- MDL: MFCD22683287
- Inchi: 1S/C7H8N2O3/c1-11-5-3-8-6(9-4-5)7(10)12-2/h3-4H,1-2H3
- InChI Key: IXSNCJLZKACDOD-UHFFFAOYSA-N
- SMILES: O(C)C1C=NC(C(=O)OC)=NC=1
Computed Properties
- Exact Mass: 168.05349212g/mol
- Monoisotopic Mass: 168.05349212g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 12
- Rotatable Bond Count: 3
- Complexity: 155
- 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
- XLogP3: -0.7
- Topological Polar Surface Area: 61.3?2
methyl 5-methoxypyrimidine-2-carboxylate Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| CHENG DOU FEI BO YI YAO Technology Co., Ltd. | FB02362-1g |
Methyl 5-methoxypyrimidine-2-carboxylate |
1415800-40-6 | 95% | 1g |
$1000 | 2023-09-07 | |
| Apollo Scientific | OR322937-100mg |
Methyl 5-methoxypyrimidine-2-carboxylate |
1415800-40-6 | 100mg |
£346.00 | 2024-07-21 | ||
| eNovation Chemicals LLC | D605257-500MG |
methyl 5-methoxypyrimidine-2-carboxylate |
1415800-40-6 | 97% | 500mg |
$150 | 2024-05-23 | |
| eNovation Chemicals LLC | D605257-1G |
methyl 5-methoxypyrimidine-2-carboxylate |
1415800-40-6 | 97% | 1g |
$205 | 2024-05-23 | |
| eNovation Chemicals LLC | D605257-5G |
methyl 5-methoxypyrimidine-2-carboxylate |
1415800-40-6 | 97% | 5g |
$595 | 2024-05-23 | |
| eNovation Chemicals LLC | D605257-10G |
methyl 5-methoxypyrimidine-2-carboxylate |
1415800-40-6 | 97% | 10g |
$995 | 2024-05-23 | |
| Chemenu | CM325549-1g |
methyl 5-methoxypyrimidine-2-carboxylate |
1415800-40-6 | 95%+ | 1g |
$193 | 2023-02-02 | |
| abcr | AB495383-500 mg |
Methyl 5-methoxypyrimidine-2-carboxylate; . |
1415800-40-6 | 500MG |
€224.90 | 2023-04-19 | ||
| abcr | AB495383-1 g |
Methyl 5-methoxypyrimidine-2-carboxylate; . |
1415800-40-6 | 1g |
€315.80 | 2023-04-19 | ||
| Chemenu | CM325549-500mg |
methyl 5-methoxypyrimidine-2-carboxylate |
1415800-40-6 | 95%+ | 500mg |
$128 | 2023-02-02 |
methyl 5-methoxypyrimidine-2-carboxylate Related Literature
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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Bruce Parkinson Energy Environ. Sci., 2010,3, 509-511
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Daniel Messmer,Stefan Salentinig,Jakob Heier Nanoscale, 2019,11, 6929-6938
Additional information on methyl 5-methoxypyrimidine-2-carboxylate
Recent Advances in the Application of Methyl 5-Methoxypyrimidine-2-carboxylate (CAS: 1415800-40-6) in Chemical Biology and Pharmaceutical Research
Methyl 5-methoxypyrimidine-2-carboxylate (CAS: 1415800-40-6) is a pyrimidine derivative that has recently garnered significant attention in chemical biology and pharmaceutical research due to its versatile applications in drug discovery and development. This compound serves as a key intermediate in the synthesis of various bioactive molecules, including kinase inhibitors, antiviral agents, and anti-inflammatory compounds. Recent studies have highlighted its potential in modulating enzymatic activity and interacting with biological targets, making it a valuable scaffold for medicinal chemistry.
In a 2023 study published in the Journal of Medicinal Chemistry, researchers explored the use of methyl 5-methoxypyrimidine-2-carboxylate as a precursor for the synthesis of novel Bruton's tyrosine kinase (BTK) inhibitors. The study demonstrated that modifications to the pyrimidine core, including the introduction of the 5-methoxy group, significantly enhanced the binding affinity and selectivity of the resulting inhibitors. The compound's unique structural features were found to improve pharmacokinetic properties, such as metabolic stability and oral bioavailability, in preclinical models.
Another recent investigation, featured in Bioorganic & Medicinal Chemistry Letters, focused on the antiviral potential of derivatives synthesized from methyl 5-methoxypyrimidine-2-carboxylate. The researchers designed a series of analogs targeting the RNA-dependent RNA polymerase (RdRp) of SARS-CoV-2. Preliminary results indicated that certain derivatives exhibited potent inhibitory activity against viral replication, with IC50 values in the low micromolar range. These findings suggest that this compound could serve as a promising starting point for developing broad-spectrum antiviral therapeutics.
Beyond its applications in drug discovery, methyl 5-methoxypyrimidine-2-carboxylate has also been utilized in chemical biology studies to probe protein-ligand interactions. A 2024 study in ACS Chemical Biology employed this compound as a chemical probe to investigate the allosteric regulation of pyrimidine metabolism enzymes. The research revealed that the methoxy and carboxylate functional groups play critical roles in stabilizing enzyme conformations, providing insights into the design of allosteric modulators for metabolic disorders.
The synthetic accessibility of methyl 5-methoxypyrimidine-2-carboxylate further enhances its appeal in pharmaceutical research. Recent advancements in green chemistry have enabled the development of efficient, scalable synthetic routes for this compound, as reported in Organic Process Research & Development. These methods emphasize the use of environmentally benign reagents and catalysts, aligning with the growing demand for sustainable drug manufacturing practices.
In conclusion, methyl 5-methoxypyrimidine-2-carboxylate (CAS: 1415800-40-6) represents a multifaceted tool in modern chemical biology and pharmaceutical research. Its applications span from drug discovery to mechanistic studies, underpinned by its unique chemical properties and synthetic versatility. Ongoing research continues to uncover new opportunities for this compound, positioning it as a valuable asset in the development of next-generation therapeutics.
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