5-(4-Butylphenyl)-3-(2-chlorophenyl)-1,2,4-oxadiazole
TL;DR: 5-(4-Butylphenyl)-3-(2-chlorophenyl)-1,2,4-oxadiazole (CAS 330460-54-3) is a chemical compound with molecular formula C18H17ClN2O and molecular weight 312.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-butylphenyl)-3-(2-chlorophenyl)-1,2,4-oxadiazole
Also Known As: 5-(4-butylphenyl)-3-(2-chlorophenyl)-1,2,4-oxadiazole, BAS 00679815, 5-(4-Butyl-phenyl)-3-(2-chloro-phenyl)-[1,2,4]oxadiazole
| Molecular Formula | C18H17ClN2O |
|---|---|
| Molecular Weight | 312.10 g/mol |
| LogP | 5.3996 |
| Topological Polar Surface Area | 38.92 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 312.10294 |
| Heavy Atoms | 22 |
| Complexity | 749.7885 |
Chemical Identifiers
| CAS Number | 330460-54-3 |
|---|---|
| SMILES | CCCCC1=CC=C(C=C1)C2=NC(=NO2)C3=CC=CC=C3Cl |
Product Overview
5-(4-Butylphenyl)-3-(2-chlorophenyl)-1,2,4-oxadiazole (CAS 330460-54-3), with molecular formula C18H17ClN2O and molecular weight 312.10 g/mol. IUPAC: 5-(4-butylphenyl)-3-(2-chlorophenyl)-1,2,4-oxadiazole.
Chemical Property Profile of 5-(4-Butylphenyl)-3-(2-chlorophenyl)-1,2,4-oxadiazole
Property Insights of 5-(4-Butylphenyl)-3-(2-chlorophenyl)-1,2,4-oxadiazole
The XLogP value of 5.3996 indicates that 5-(4-Butylphenyl)-3-(2-chlorophenyl)-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 38.92 Ų, 5-(4-Butylphenyl)-3-(2-chlorophenyl)-1,2,4-oxadiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(4-Butylphenyl)-3-(2-chlorophenyl)-1,2,4-oxadiazole has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-(4-Butylphenyl)-3-(2-chlorophenyl)-1,2,4-oxadiazole?
The CAS number of 5-(4-Butylphenyl)-3-(2-chlorophenyl)-1,2,4-oxadiazole is 330460-54-3.
What is the molecular formula of 5-(4-Butylphenyl)-3-(2-chlorophenyl)-1,2,4-oxadiazole?
The molecular formula of 5-(4-Butylphenyl)-3-(2-chlorophenyl)-1,2,4-oxadiazole is C18H17ClN2O.
What is the molecular weight of 5-(4-Butylphenyl)-3-(2-chlorophenyl)-1,2,4-oxadiazole?
The molecular weight of 5-(4-Butylphenyl)-3-(2-chlorophenyl)-1,2,4-oxadiazole is 312.10 g/mol.
Where can I buy 5-(4-Butylphenyl)-3-(2-chlorophenyl)-1,2,4-oxadiazole?
You can request a quote for 5-(4-Butylphenyl)-3-(2-chlorophenyl)-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-(4-Butylphenyl)-3-(2-chlorophenyl)-1,2,4-oxadiazole?
Yes, KEHONG BIO provides custom synthesis services for 5-(4-Butylphenyl)-3-(2-chlorophenyl)-1,2,4-oxadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.