Libexin
TL;DR: Libexin (CAS 982-43-4) is a chemical compound with molecular formula C23H28ClN3O and molecular weight 397.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,2-diphenylethyl)-5-(2-piperidin-1-ylethyl)-1,2,4-oxadiazole;hydrochloride
Also Known As: Libexin, Lomapect, Tibexin, libeksin, Toparten
| Molecular Formula | C23H28ClN3O |
|---|---|
| Molecular Weight | 397.19 g/mol |
| LogP | 4.89 |
| Topological Polar Surface Area | 42.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 397.19208 |
| Heavy Atoms | 28 |
| Complexity | 396.0 |
Chemical Identifiers
| CAS Number | 982-43-4 |
|---|---|
| SMILES | C1CCN(CC1)CCC2=NC(=NO2)CC(C3=CC=CC=C3)C4=CC=CC=C4.Cl |
| InChIKey | ONTOFAWPPHNLML-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Libexin (CAS 982-43-4), with molecular formula C23H28ClN3O and molecular weight 397.19 g/mol. IUPAC: 3-(2,2-diphenylethyl)-5-(2-piperidin-1-ylethyl)-1,2,4-oxadiazole;hydrochloride.
Chemical Property Profile of Libexin
Property Insights of Libexin
The XLogP value of 4.89 indicates that Libexin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.2 Ų, Libexin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Libexin has 1 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 Libexin?
The CAS number of Libexin is 982-43-4.
What is the molecular formula of Libexin?
The molecular formula of Libexin is C23H28ClN3O.
What is the molecular weight of Libexin?
The molecular weight of Libexin is 397.19 g/mol.
Where can I buy Libexin?
You can request a quote for Libexin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Libexin?
Yes, KEHONG BIO provides custom synthesis services for Libexin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.