Lifibrol
TL;DR: Lifibrol (CAS 96609-16-4) is a chemical compound with molecular formula C21H26O4 and molecular weight 342.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-(4-tert-butylphenyl)-2-hydroxybutoxy]benzoic acid
Also Known As: LIFIBROL, Lifibrolum, (R)-Lifibrol, (S)-Lifibrol, Lifibrol [USAN:INN]
| Molecular Formula | C21H26O4 |
|---|---|
| Molecular Weight | 342.18 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 342.1831 |
| Heavy Atoms | 25 |
| Complexity | 399.0 |
Chemical Identifiers
| CAS Number | 96609-16-4 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)CCC(COC2=CC=C(C=C2)C(=O)O)O |
| InChIKey | LNXBEIZREVRNTF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Lifibrol (CAS 96609-16-4), with molecular formula C21H26O4 and molecular weight 342.18 g/mol. IUPAC: 4-[4-(4-tert-butylphenyl)-2-hydroxybutoxy]benzoic acid.
Chemical Property Profile of Lifibrol
Property Insights of Lifibrol
The XLogP value of 4.8 indicates that Lifibrol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Lifibrol. Following Lipinski's Rule of Five, Lifibrol has 2 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 Lifibrol?
The CAS number of Lifibrol is 96609-16-4.
What is the molecular formula of Lifibrol?
The molecular formula of Lifibrol is C21H26O4.
What is the molecular weight of Lifibrol?
The molecular weight of Lifibrol is 342.18 g/mol.
Where can I buy Lifibrol?
You can request a quote for Lifibrol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Lifibrol?
Yes, KEHONG BIO provides custom synthesis services for Lifibrol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.