5-(3-Fluorophenyl)-3-(4-pyridyl)-1,2,4-oxadiazole
TL;DR: 5-(3-Fluorophenyl)-3-(4-pyridyl)-1,2,4-oxadiazole (CAS 696654-68-9) is a chemical compound with molecular formula C13H8FN3O and molecular weight 241.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(3-fluorophenyl)-3-pyridin-4-yl-1,2,4-oxadiazole
Also Known As: BAS 13323631, 5-(3-fluorophenyl)-3-(4-pyridyl)-1,2,4-oxadiazole, 5-(3-fluorophenyl)-3-pyridin-4-yl-1,2,4-oxadiazole, AB01319446-02, 4-[5-(3-fluorophenyl)-1,2,4-oxadiazol-3-yl]pyridine
| Molecular Formula | C13H8FN3O |
|---|---|
| Molecular Weight | 241.07 g/mol |
| LogP | 2.9377 |
| Topological Polar Surface Area | 51.81 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 241.06514 |
| Heavy Atoms | 18 |
| Complexity | 666.76294 |
Chemical Identifiers
| CAS Number | 696654-68-9 |
|---|---|
| SMILES | C1=CC(=CC(=C1)F)C2=NC(=NO2)C3=CC=NC=C3 |
Product Overview
5-(3-Fluorophenyl)-3-(4-pyridyl)-1,2,4-oxadiazole (CAS 696654-68-9), with molecular formula C13H8FN3O and molecular weight 241.07 g/mol. IUPAC: 5-(3-fluorophenyl)-3-pyridin-4-yl-1,2,4-oxadiazole.
Chemical Property Profile of 5-(3-Fluorophenyl)-3-(4-pyridyl)-1,2,4-oxadiazole
Property Insights of 5-(3-Fluorophenyl)-3-(4-pyridyl)-1,2,4-oxadiazole
The XLogP value of 2.9377 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(3-Fluorophenyl)-3-(4-pyridyl)-1,2,4-oxadiazole. With a topological polar surface area (TPSA) of 51.81 Ų, 5-(3-Fluorophenyl)-3-(4-pyridyl)-1,2,4-oxadiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(3-Fluorophenyl)-3-(4-pyridyl)-1,2,4-oxadiazole has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-(3-Fluorophenyl)-3-(4-pyridyl)-1,2,4-oxadiazole?
The CAS number of 5-(3-Fluorophenyl)-3-(4-pyridyl)-1,2,4-oxadiazole is 696654-68-9.
What is the molecular formula of 5-(3-Fluorophenyl)-3-(4-pyridyl)-1,2,4-oxadiazole?
The molecular formula of 5-(3-Fluorophenyl)-3-(4-pyridyl)-1,2,4-oxadiazole is C13H8FN3O.
What is the molecular weight of 5-(3-Fluorophenyl)-3-(4-pyridyl)-1,2,4-oxadiazole?
The molecular weight of 5-(3-Fluorophenyl)-3-(4-pyridyl)-1,2,4-oxadiazole is 241.07 g/mol.
Where can I buy 5-(3-Fluorophenyl)-3-(4-pyridyl)-1,2,4-oxadiazole?
You can request a quote for 5-(3-Fluorophenyl)-3-(4-pyridyl)-1,2,4-oxadiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(3-Fluorophenyl)-3-(4-pyridyl)-1,2,4-oxadiazole?
Yes, KEHONG BIO provides custom synthesis services for 5-(3-Fluorophenyl)-3-(4-pyridyl)-1,2,4-oxadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.