5-Chloropyrazolo[1,5-a]pyrimidin-7(1H)-one
CAS No.:
99898-84-7
M. Wt:
169.56800
M. Fa:
C6H4ClN3O
InChI Key:
IYNABQNUIXYONK-UHFFFAOYSA-N
Appearance:
White Solid
Names and Identifiers of 99898-84-7
CAS Number |
99898-84-7 |
|---|---|
MDL Number |
MFCD27997216 |
IUPAC Name |
5-chloro-1H-pyrazolo[1,5-a]pyrimidin-7-one |
InChI |
InChI=1S/C6H4ClN3O/c7-4-3-6(11)10-5(9-4)1-2-8-10/h1-3,8H |
InChIKey |
IYNABQNUIXYONK-UHFFFAOYSA-N |
Canonical SMILES |
C1=CNN2C1=NC(=CC2=O)Cl |
UNSPSC Code |
12352100 |
Physical and chemical properties of 99898-84-7
Exact Mass |
169.00400 |
|---|---|
LogP |
0.67600 |
Molecular Formula |
C6H4ClN3O |
Molecular Weight |
169.56800 |
PSA |
50.16000 |
Storage condition |
under inert gas (nitrogen or Argon) at 2-8°C |
Safety Information of 99898-84-7
Applications of 99898-84-7
The applications of 5-chloropyrazolo[1,5-a]pyrimidin-7(1H)-one span various fields:
- Medicinal Chemistry: Due to its biological activity, it is being explored as a lead compound for developing new anticancer and anti-inflammatory drugs.
- Fluorescent Probes: Some derivatives are investigated for their potential as fluorescent probes in biological imaging due to their photophysical properties .
- Material Science: The compound's unique electronic properties make it suitable for applications in organic electronics and as components in organic light-emitting diodes (OLEDs) .
Interaction Studies of 99898-84-7
Interaction studies reveal that 5-chloropyrazolo[1,5-a]pyrimidin-7(1H)-one can interact with various biological targets:
- Protein Kinases: It has been shown to inhibit specific kinases involved in cancer signaling pathways.
- Receptors: Binding studies indicate potential interaction with certain receptors that modulate cellular responses.
- Enzymatic Pathways: The compound's ability to inhibit enzymes suggests it could affect metabolic pathways relevant to disease processes .
Biological Activity of 99898-84-7
Research indicates that pyrazolo[1,5-a]pyrimidine derivatives exhibit significant biological activities, including:
- Anticancer Properties: Compounds in this class have shown potential in inhibiting cancer cell proliferation and inducing apoptosis in various cancer cell lines.
- Anti-inflammatory Effects: Some derivatives have demonstrated anti-inflammatory activity, making them candidates for treating inflammatory diseases.
- Enzyme Inhibition: Certain pyrazolo[1,5-a]pyrimidines act as inhibitors of specific enzymes involved in disease pathways, such as kinases .
Physical sample testing spectrum (NMR) of 99898-84-7
