8-Benzyloxy-5-(2-bromoacetyl)-2-hydroxyquinoline
Names and Identifiers of 100331-89-3
CAS Number |
100331-89-3 |
|---|---|
EC Number |
675-817-4 |
IUPAC Name |
5-(2-bromoacetyl)-8-phenylmethoxy-1H-quinolin-2-one |
InChI |
InChI=1S/C18H14BrNO3/c19-10-15(21)13-6-8-16(18-14(13)7-9-17(22)20-18)23-11-12-4-2-1-3-5-12/h1-9H,10-11H2,(H,20,22) |
InChIKey |
RVHSDLUBNZBRMH-UHFFFAOYSA-N |
Canonical SMILES |
C1=CC=C(C=C1)COC2=C3C(=C(C=C2)C(=O)CBr)C=CC(=O)N3 |
Physical and chemical properties of 100331-89-3
Acidity coefficient |
10.38±0.70(Predicted) |
|---|---|
Boiling Point |
596.4±45.0 °C at 760 mmHg |
Density |
1.5±0.1 g/cm3 |
Exact Mass |
371.015686 |
Flash Point |
314.5±28.7 °C |
Index of Refraction |
1.685 |
LogP |
3.48 |
Melting Point |
192-194oC |
Molecular Formula |
C18H14BrNO3 |
Molecular Weight |
372.213 |
PSA |
59.42000 |
Solubility |
Chloroform (Sparingly), Ethyl Acetate (Slightly) |
Stability |
Unstable in DMSO |
Storage condition |
2-8°C |
Vapour Pressure |
0.0±1.7 mmHg at 25°C |
Safety Information of 100331-89-3
Applications of 100331-89-3
8-Benzyloxy-5-(2-bromoacetyl)-2-hydroxyquinoline has several applications:
- Pharmaceutical Development: Its role as a β₂ adrenoreceptor agonist makes it valuable in developing medications for respiratory conditions.
- Chemical Research: It serves as an intermediate for synthesizing other biologically active compounds, particularly those related to adrenergic signaling.
- Analytical Chemistry: The compound may also be used in various analytical techniques due to its unique spectral properties.
Interaction Studies of 100331-89-3
Studies on the interactions of 8-Benzyloxy-5-(2-bromoacetyl)-2-hydroxyquinoline with biological targets have shown promising results. Its ability to bind to β₂ adrenoreceptors suggests that it could modulate physiological responses effectively. Further research into its pharmacokinetics and pharmacodynamics is necessary to fully understand its therapeutic potential and any possible side effects associated with its use.
Biological Activity of 100331-89-3
Research indicates that 8-Benzyloxy-5-(2-bromoacetyl)-2-hydroxyquinoline exhibits significant biological activity, particularly as a β₂ adrenoreceptor agonist. This activity suggests potential applications in treating conditions such as asthma and other respiratory disorders by promoting bronchodilation. The compound's structure allows it to interact effectively with adrenergic receptors, which are crucial for mediating physiological responses to catecholamines.
Physical sample testing spectrum (NMR) of 100331-89-3
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