5-(3,4-Dimethylphenyl)-3-(3-methoxyphenyl)-1,2,4-oxadiazole
TL;DR: 5-(3,4-Dimethylphenyl)-3-(3-methoxyphenyl)-1,2,4-oxadiazole (CAS 894516-72-4) is a chemical compound with molecular formula C17H16N2O2 and molecular weight 280.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(3,4-dimethylphenyl)-3-(3-methoxyphenyl)-1,2,4-oxadiazole
Also Known As: 5-(3,4-dimethylphenyl)-3-(3-methoxyphenyl)-1,2,4-oxadiazole
| Molecular Formula | C17H16N2O2 |
|---|---|
| Molecular Weight | 280.12 g/mol |
| LogP | 4.02904 |
| Topological Polar Surface Area | 48.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 280.1212 |
| Heavy Atoms | 21 |
| Complexity | 777.9662 |
Chemical Identifiers
| CAS Number | 894516-72-4 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C2=NC(=NO2)C3=CC(=CC=C3)OC)C |
Product Overview
5-(3,4-Dimethylphenyl)-3-(3-methoxyphenyl)-1,2,4-oxadiazole (CAS 894516-72-4), with molecular formula C17H16N2O2 and molecular weight 280.12 g/mol. IUPAC: 5-(3,4-dimethylphenyl)-3-(3-methoxyphenyl)-1,2,4-oxadiazole.
Chemical Property Profile of 5-(3,4-Dimethylphenyl)-3-(3-methoxyphenyl)-1,2,4-oxadiazole
Property Insights of 5-(3,4-Dimethylphenyl)-3-(3-methoxyphenyl)-1,2,4-oxadiazole
The XLogP value of 4.02904 indicates that 5-(3,4-Dimethylphenyl)-3-(3-methoxyphenyl)-1,2,4-oxadiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.15 Ų, 5-(3,4-Dimethylphenyl)-3-(3-methoxyphenyl)-1,2,4-oxadiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(3,4-Dimethylphenyl)-3-(3-methoxyphenyl)-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-(3,4-Dimethylphenyl)-3-(3-methoxyphenyl)-1,2,4-oxadiazole?
The CAS number of 5-(3,4-Dimethylphenyl)-3-(3-methoxyphenyl)-1,2,4-oxadiazole is 894516-72-4.
What is the molecular formula of 5-(3,4-Dimethylphenyl)-3-(3-methoxyphenyl)-1,2,4-oxadiazole?
The molecular formula of 5-(3,4-Dimethylphenyl)-3-(3-methoxyphenyl)-1,2,4-oxadiazole is C17H16N2O2.
What is the molecular weight of 5-(3,4-Dimethylphenyl)-3-(3-methoxyphenyl)-1,2,4-oxadiazole?
The molecular weight of 5-(3,4-Dimethylphenyl)-3-(3-methoxyphenyl)-1,2,4-oxadiazole is 280.12 g/mol.
Where can I buy 5-(3,4-Dimethylphenyl)-3-(3-methoxyphenyl)-1,2,4-oxadiazole?
You can request a quote for 5-(3,4-Dimethylphenyl)-3-(3-methoxyphenyl)-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-(3,4-Dimethylphenyl)-3-(3-methoxyphenyl)-1,2,4-oxadiazole?
Yes, KEHONG BIO provides custom synthesis services for 5-(3,4-Dimethylphenyl)-3-(3-methoxyphenyl)-1,2,4-oxadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.