Cas no 98025-14-0 (6-Chloro-2-(methylamino)pyrimidin-4(3H)-one)

6-Chloro-2-(methylamino)pyrimidin-4(3H)-one is a heterocyclic compound featuring a pyrimidinone core substituted with a chloro group at the 6-position and a methylamino group at the 2-position. This structure imparts reactivity suitable for further functionalization, making it a valuable intermediate in pharmaceutical and agrochemical synthesis. The chloro group enhances electrophilic substitution potential, while the methylamino moiety contributes to hydrogen bonding and solubility properties. Its well-defined crystalline form ensures consistent purity and stability, facilitating precise applications in medicinal chemistry, particularly in the development of kinase inhibitors and antimicrobial agents. The compound's balanced reactivity and stability make it a reliable building block for complex molecular architectures.
6-Chloro-2-(methylamino)pyrimidin-4(3H)-one structure
98025-14-0 structure
Product Name:6-Chloro-2-(methylamino)pyrimidin-4(3H)-one
CAS No:98025-14-0
MF:C5H6ClN3O
MW:159.5736
MDL:MFCD02091103
CID:4741729
Update Time:2025-10-31

6-Chloro-2-(methylamino)pyrimidin-4(3H)-one Chemical and Physical Properties

Names and Identifiers

    • 6-chloro-2-(methylamino)pyrimidin-4(3H)-one
    • SBB087395
    • 6-chloro-2-(methylamino)-3-hydropyrimidin-4-one
    • 6-chloro-2-(methylamino)-3,4-dihydropyrimidin-4-one
    • 6-Chloro-2-(methylamino)pyrimidin-4(3H)-one
    • MDL: MFCD02091103
    • Inchi: 1S/C5H6ClN3O/c1-7-5-8-3(6)2-4(10)9-5/h2H,1H3,(H2,7,8,9,10)
    • InChI Key: IKHMHNUAKNXSFV-UHFFFAOYSA-N
    • SMILES: ClC1=C([H])C(N([H])C(=N1)N([H])C([H])([H])[H])=O

Computed Properties

  • Exact Mass: 159.019939g/mol
  • Monoisotopic Mass: 159.019939g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 1
  • Complexity: 221
  • 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: 53.5
  • Molecular Weight: 159.57g/mol
  • XLogP3: -0.1

6-Chloro-2-(methylamino)pyrimidin-4(3H)-one Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
eNovation Chemicals LLC
Y1194070-1g
6-Chloro-2-(methylamino)pyrimidin-4(3H)-one
98025-14-0 95%
1g
$825 2025-02-19
SHANG HAI HAO HONG Biomedical Technology Co., Ltd.
1528458-1g
6-Chloro-2-(methylamino)pyrimidin-4(3H)-one
98025-14-0 98%
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¥7559.00 2024-04-23
eNovation Chemicals LLC
Y1194070-1g
6-Chloro-2-(methylamino)pyrimidin-4(3H)-one
98025-14-0 95%
1g
$825 2024-07-20
eNovation Chemicals LLC
Y1194070-1g
6-Chloro-2-(methylamino)pyrimidin-4(3H)-one
98025-14-0 95%
1g
$825 2025-02-27

Additional information on 6-Chloro-2-(methylamino)pyrimidin-4(3H)-one

Recent Advances in the Study of 6-Chloro-2-(methylamino)pyrimidin-4(3H)-one (CAS: 98025-14-0)

The compound 6-Chloro-2-(methylamino)pyrimidin-4(3H)-one (CAS: 98025-14-0) has recently garnered significant attention in the field of chemical biology and pharmaceutical research. This heterocyclic pyrimidine derivative is recognized for its potential as a key intermediate in the synthesis of biologically active molecules, particularly in the development of kinase inhibitors and antiviral agents. Recent studies have explored its structural properties, synthetic pathways, and therapeutic applications, making it a focal point in drug discovery efforts.

One of the most notable advancements in the study of 6-Chloro-2-(methylamino)pyrimidin-4(3H)-one is its role in the design of selective kinase inhibitors. Kinases play a critical role in cellular signaling pathways, and their dysregulation is often associated with cancer and other diseases. Researchers have successfully utilized this compound as a scaffold to develop inhibitors targeting specific kinases, such as cyclin-dependent kinases (CDKs) and mitogen-activated protein kinases (MAPKs). These inhibitors have shown promising results in preclinical studies, demonstrating potent activity and selectivity.

In addition to its applications in kinase inhibition, 6-Chloro-2-(methylamino)pyrimidin-4(3H)-one has been investigated for its antiviral properties. Recent studies have highlighted its potential as a precursor in the synthesis of nucleoside analogs, which are widely used in antiviral therapies. For instance, modifications of this compound have led to the development of novel agents with activity against RNA viruses, including influenza and coronaviruses. These findings underscore the versatility of this pyrimidine derivative in addressing global health challenges.

The synthetic chemistry of 6-Chloro-2-(methylamino)pyrimidin-4(3H)-one has also seen significant progress. Researchers have developed more efficient and scalable methods for its preparation, enabling its broader use in medicinal chemistry. Green chemistry approaches, such as catalytic reactions and solvent-free conditions, have been employed to minimize environmental impact while maintaining high yields and purity. These advancements are critical for the large-scale production of this compound and its derivatives.

Despite these promising developments, challenges remain in the optimization of 6-Chloro-2-(methylamino)pyrimidin-4(3H)-one-based therapeutics. Issues such as bioavailability, metabolic stability, and off-target effects need to be addressed to fully realize its clinical potential. Ongoing research is focused on structural modifications and formulation strategies to overcome these limitations. Collaborative efforts between academia and industry are expected to accelerate the translation of these findings into viable drug candidates.

In conclusion, 6-Chloro-2-(methylamino)pyrimidin-4(3H)-one (CAS: 98025-14-0) represents a valuable scaffold in modern drug discovery. Its applications in kinase inhibition and antiviral therapy, coupled with advancements in synthetic methodologies, highlight its importance in chemical biology and pharmaceutical research. Future studies will likely explore its potential in other therapeutic areas, further solidifying its role in the development of next-generation therapeutics.

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