3-(2-Chlorophenyl)-5-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole
TL;DR: 3-(2-Chlorophenyl)-5-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole (CAS 313981-76-9) is a chemical compound with molecular formula C16H13ClN2O3 and molecular weight 316.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-chlorophenyl)-5-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole
Also Known As: BAS 00679832, 3-(2-chlorophenyl)-5-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole, AB00097088-01, 3-(2-Chloro-phenyl)-5-(3,4-dimethoxy-phenyl)-[1,2,4]oxadiazole
| Molecular Formula | C16H13ClN2O3 |
|---|---|
| Molecular Weight | 316.06 g/mol |
| LogP | 4.0742 |
| Topological Polar Surface Area | 57.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 316.06146 |
| Heavy Atoms | 22 |
| Complexity | 801.58997 |
Chemical Identifiers
| CAS Number | 313981-76-9 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2=NC(=NO2)C3=CC=CC=C3Cl)OC |
Product Overview
3-(2-Chlorophenyl)-5-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole (CAS 313981-76-9), with molecular formula C16H13ClN2O3 and molecular weight 316.06 g/mol. IUPAC: 3-(2-chlorophenyl)-5-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole.
Chemical Property Profile of 3-(2-Chlorophenyl)-5-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole
Property Insights of 3-(2-Chlorophenyl)-5-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole
The XLogP value of 4.0742 indicates that 3-(2-Chlorophenyl)-5-(3,4-dimethoxyphenyl)-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 57.38 Ų, 3-(2-Chlorophenyl)-5-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-Chlorophenyl)-5-(3,4-dimethoxyphenyl)-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-(2-Chlorophenyl)-5-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole?
The CAS number of 3-(2-Chlorophenyl)-5-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole is 313981-76-9.
What is the molecular formula of 3-(2-Chlorophenyl)-5-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole?
The molecular formula of 3-(2-Chlorophenyl)-5-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole is C16H13ClN2O3.
What is the molecular weight of 3-(2-Chlorophenyl)-5-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole?
The molecular weight of 3-(2-Chlorophenyl)-5-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole is 316.06 g/mol.
Where can I buy 3-(2-Chlorophenyl)-5-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole?
You can request a quote for 3-(2-Chlorophenyl)-5-(3,4-dimethoxyphenyl)-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-(2-Chlorophenyl)-5-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-Chlorophenyl)-5-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.