![structure of 1-{[5-(2-Fluorophenyl)thiophen-2-yl]methyl}piperazine](https://molwiki.oss-cn-hongkong.aliyuncs.com/structure/42/1000932-42-2.svg)
1-{[5-(2-Fluorophenyl)thiophen-2-yl]methyl}piperazine
CAS No.:
1000932-42-2
M. Wt:
276.37
M. Fa:
C15H17FN2S
InChI Key:
MAFYHQLPVBHQDK-UHFFFAOYSA-N
Names and Identifiers of 1000932-42-2
CAS Number |
1000932-42-2 |
|---|---|
IUPAC Name |
1-[[5-(2-fluorophenyl)thiophen-2-yl]methyl]piperazine |
InChI |
InChI=1S/C15H17FN2S/c16-14-4-2-1-3-13(14)15-6-5-12(19-15)11-18-9-7-17-8-10-18/h1-6,17H,7-11H2 |
InChIKey |
MAFYHQLPVBHQDK-UHFFFAOYSA-N |
Canonical SMILES |
C1CN(CCN1)CC2=CC=C(S2)C3=CC=CC=C3F |
Physical and chemical properties of 1000932-42-2
Boiling Point |
379.8±37.0 °C(Predicted) |
|---|---|
Density |
1?+-.0.06 g/cm3(Predicted) |
Molecular Formula |
C15H17FN2S |
Molecular Weight |
276.37 |
Safety Information of 1000932-42-2
Interaction Studies of 1000932-42-2
Studies on the interactions of 1-{[5-(2-Fluorophenyl)thiophen-2-yl]methyl}piperazine with biological targets have indicated that it may effectively bind to various receptors involved in neurotransmission. Interaction studies often employ techniques such as:
- Molecular docking: To predict binding affinities and orientations within receptor sites.
- In vitro assays: To evaluate functional responses in cell lines expressing specific receptors.
These studies help elucidate the compound's mechanism of action and potential therapeutic effects.
Similar CompoundsSeveral compounds share structural similarities with 1-{[5-(2-Fluorophenyl)thiophen-2-yl]methyl}piperazine. These include:
| Compound Name | Structure | Notable Features |
|---|---|---|
| 1-(4-Fluorophenyl)piperazine | C₁₄H₁₈FN₂ | Commonly used in antidepressants |
| 5-(4-Methylphenyl)thiophene | C₁₄H₁₄S | Exhibits anti-inflammatory properties |
| N-[1-(4-Pyridinyl)piperidin-4-yl]thiazole | C₁₅H₁₈N₂S | Investigated for anti-cancer activity |
Biological Activity of 1000932-42-2
1-{[5-(2-Fluorophenyl)thiophen-2-yl]methyl}piperazine exhibits significant biological activity, particularly as a modulator of various receptors. Compounds containing piperazine are often investigated for their effects on neurotransmitter systems, including:
- Dopamine receptors: Potential applications in treating psychiatric disorders.
- Serotonin receptors: Implications in mood regulation and anxiety disorders.
- P2X receptors: Some derivatives have shown promise as analgesics by modulating pain pathways.