3-(3-(4-Methoxyphenyl)-1,2,4-oxadiazol-5-yl)propanoic acid
TL;DR: 3-(3-(4-Methoxyphenyl)-1,2,4-oxadiazol-5-yl)propanoic acid (CAS 94192-18-4) is a chemical compound with molecular formula C12H12N2O4 and molecular weight 248.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoic acid
Also Known As: 3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoic acid, Maybridge3_001311, 3-[3-(4-Methoxy-phenyl)-[1,2,4]oxadiazol-5-yl]-propionic acid, 3-(3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl)propanoic acid, IDI1_012698
| Molecular Formula | C12H12N2O4 |
|---|---|
| Molecular Weight | 248.08 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 85.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 248.07971 |
| Heavy Atoms | 18 |
| Complexity | 279.0 |
Chemical Identifiers
| CAS Number | 94192-18-4 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=NOC(=N2)CCC(=O)O |
| InChIKey | WRFNXLGYERRRTO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(3-(4-Methoxyphenyl)-1,2,4-oxadiazol-5-yl)propanoic acid (CAS 94192-18-4), with molecular formula C12H12N2O4 and molecular weight 248.08 g/mol. IUPAC: 3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoic acid.
Chemical Property Profile of 3-(3-(4-Methoxyphenyl)-1,2,4-oxadiazol-5-yl)propanoic acid
Property Insights of 3-(3-(4-Methoxyphenyl)-1,2,4-oxadiazol-5-yl)propanoic acid
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(3-(4-Methoxyphenyl)-1,2,4-oxadiazol-5-yl)propanoic acid. The TPSA of 85.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(3-(4-Methoxyphenyl)-1,2,4-oxadiazol-5-yl)propanoic acid. Following Lipinski's Rule of Five, 3-(3-(4-Methoxyphenyl)-1,2,4-oxadiazol-5-yl)propanoic acid has 1 hydrogen bond donor(s) and 6 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-(3-(4-Methoxyphenyl)-1,2,4-oxadiazol-5-yl)propanoic acid?
The CAS number of 3-(3-(4-Methoxyphenyl)-1,2,4-oxadiazol-5-yl)propanoic acid is 94192-18-4.
What is the molecular formula of 3-(3-(4-Methoxyphenyl)-1,2,4-oxadiazol-5-yl)propanoic acid?
The molecular formula of 3-(3-(4-Methoxyphenyl)-1,2,4-oxadiazol-5-yl)propanoic acid is C12H12N2O4.
What is the molecular weight of 3-(3-(4-Methoxyphenyl)-1,2,4-oxadiazol-5-yl)propanoic acid?
The molecular weight of 3-(3-(4-Methoxyphenyl)-1,2,4-oxadiazol-5-yl)propanoic acid is 248.08 g/mol.
Where can I buy 3-(3-(4-Methoxyphenyl)-1,2,4-oxadiazol-5-yl)propanoic acid?
You can request a quote for 3-(3-(4-Methoxyphenyl)-1,2,4-oxadiazol-5-yl)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3-(4-Methoxyphenyl)-1,2,4-oxadiazol-5-yl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-(4-Methoxyphenyl)-1,2,4-oxadiazol-5-yl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.