3-(4-Fluorophenyl)-5-(4-nitrophenyl)-1,2,4-oxadiazole
TL;DR: 3-(4-Fluorophenyl)-5-(4-nitrophenyl)-1,2,4-oxadiazole (CAS 171622-52-9) is a chemical compound with molecular formula C14H8FN3O3 and molecular weight 285.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-fluorophenyl)-5-(4-nitrophenyl)-1,2,4-oxadiazole
Also Known As: BAS 00294047, 3-(4-fluorophenyl)-5-(4-nitrophenyl)-1,2,4-oxadiazole, 3-(4-Fluoro-phenyl)-5-(4-nitro-phenyl)-[1,2,4]oxadiazole
| Molecular Formula | C14H8FN3O3 |
|---|---|
| Molecular Weight | 285.05 g/mol |
| LogP | 3.4509 |
| Topological Polar Surface Area | 82.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 285.05496 |
| Heavy Atoms | 21 |
| Complexity | 781.98376 |
Chemical Identifiers
| CAS Number | 171622-52-9 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=NC(=NO2)C3=CC=C(C=C3)F)[N+](=O)[O-] |
Product Overview
3-(4-Fluorophenyl)-5-(4-nitrophenyl)-1,2,4-oxadiazole (CAS 171622-52-9), with molecular formula C14H8FN3O3 and molecular weight 285.05 g/mol. IUPAC: 3-(4-fluorophenyl)-5-(4-nitrophenyl)-1,2,4-oxadiazole.
Chemical Property Profile of 3-(4-Fluorophenyl)-5-(4-nitrophenyl)-1,2,4-oxadiazole
Property Insights of 3-(4-Fluorophenyl)-5-(4-nitrophenyl)-1,2,4-oxadiazole
The XLogP value of 3.4509 indicates that 3-(4-Fluorophenyl)-5-(4-nitrophenyl)-1,2,4-oxadiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-Fluorophenyl)-5-(4-nitrophenyl)-1,2,4-oxadiazole. Following Lipinski's Rule of Five, 3-(4-Fluorophenyl)-5-(4-nitrophenyl)-1,2,4-oxadiazole has 0 hydrogen bond donor(s) and 5 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 3-(4-Fluorophenyl)-5-(4-nitrophenyl)-1,2,4-oxadiazole?
The CAS number of 3-(4-Fluorophenyl)-5-(4-nitrophenyl)-1,2,4-oxadiazole is 171622-52-9.
What is the molecular formula of 3-(4-Fluorophenyl)-5-(4-nitrophenyl)-1,2,4-oxadiazole?
The molecular formula of 3-(4-Fluorophenyl)-5-(4-nitrophenyl)-1,2,4-oxadiazole is C14H8FN3O3.
What is the molecular weight of 3-(4-Fluorophenyl)-5-(4-nitrophenyl)-1,2,4-oxadiazole?
The molecular weight of 3-(4-Fluorophenyl)-5-(4-nitrophenyl)-1,2,4-oxadiazole is 285.05 g/mol.
Where can I buy 3-(4-Fluorophenyl)-5-(4-nitrophenyl)-1,2,4-oxadiazole?
You can request a quote for 3-(4-Fluorophenyl)-5-(4-nitrophenyl)-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 3-(4-Fluorophenyl)-5-(4-nitrophenyl)-1,2,4-oxadiazole?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Fluorophenyl)-5-(4-nitrophenyl)-1,2,4-oxadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.