![4-[3-(4-Chlorophenyl)-1,2,4-oxadiazol-5-yl]butanoic acid structure](/static/products/4391/439108-15-3.webp)
4-[3-(4-Chlorophenyl)-1,2,4-oxadiazol-5-yl]butanoic acid
TL;DR: 4-[3-(4-Chlorophenyl)-1,2,4-oxadiazol-5-yl]butanoic acid (CAS 439108-15-3) is a chemical compound with molecular formula C12H11ClN2O3 and molecular weight 266.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]butanoic acid
Also Known As: 4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]butanoic acid, Ligand 8, Maybridge1_003623, 3-(4-Chlorophenyl)-1,2,4-oxadiazole-5-butanoic Acid, 4-(3-(4-Chlorophenyl)-1,2,4-oxadiazol-5-yl)butanoic acid
| Molecular Formula | C12H11ClN2O3 |
|---|---|
| Molecular Weight | 266.05 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 76.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 266.0458 |
| Heavy Atoms | 18 |
| Complexity | 282.0 |
Chemical Identifiers
| CAS Number | 439108-15-3 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=NOC(=N2)CCCC(=O)O)Cl |
| InChIKey | ROMPPAWVATWIKR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-[3-(4-Chlorophenyl)-1,2,4-oxadiazol-5-yl]butanoic acid (CAS 439108-15-3), with molecular formula C12H11ClN2O3 and molecular weight 266.05 g/mol. IUPAC: 4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]butanoic acid.
Chemical Property Profile of 4-[3-(4-Chlorophenyl)-1,2,4-oxadiazol-5-yl]butanoic acid
Property Insights of 4-[3-(4-Chlorophenyl)-1,2,4-oxadiazol-5-yl]butanoic acid
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[3-(4-Chlorophenyl)-1,2,4-oxadiazol-5-yl]butanoic acid. The TPSA of 76.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[3-(4-Chlorophenyl)-1,2,4-oxadiazol-5-yl]butanoic acid. Following Lipinski's Rule of Five, 4-[3-(4-Chlorophenyl)-1,2,4-oxadiazol-5-yl]butanoic acid has 1 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 4-[3-(4-Chlorophenyl)-1,2,4-oxadiazol-5-yl]butanoic acid?
The CAS number of 4-[3-(4-Chlorophenyl)-1,2,4-oxadiazol-5-yl]butanoic acid is 439108-15-3.
What is the molecular formula of 4-[3-(4-Chlorophenyl)-1,2,4-oxadiazol-5-yl]butanoic acid?
The molecular formula of 4-[3-(4-Chlorophenyl)-1,2,4-oxadiazol-5-yl]butanoic acid is C12H11ClN2O3.
What is the molecular weight of 4-[3-(4-Chlorophenyl)-1,2,4-oxadiazol-5-yl]butanoic acid?
The molecular weight of 4-[3-(4-Chlorophenyl)-1,2,4-oxadiazol-5-yl]butanoic acid is 266.05 g/mol.
Where can I buy 4-[3-(4-Chlorophenyl)-1,2,4-oxadiazol-5-yl]butanoic acid?
You can request a quote for 4-[3-(4-Chlorophenyl)-1,2,4-oxadiazol-5-yl]butanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[3-(4-Chlorophenyl)-1,2,4-oxadiazol-5-yl]butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[3-(4-Chlorophenyl)-1,2,4-oxadiazol-5-yl]butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.