Ici 54856
TL;DR: Ici 54856 (CAS 21340-66-9) is a chemical compound with molecular formula C16H15ClO3 and molecular weight 290.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(4-chlorophenyl)phenoxy]-2-methylpropanoic acid
Also Known As: CLOFENAPIC ACID, Ici 54856, Propanoic acid, 2-((4'-chloro(1,1'-biphenyl)-4-yl)oxy)-2-methyl-, 2-[4-(4-chlorophenyl)phenoxy]-2-methylpropanoic acid, 2-[(4'-Chloro[1,1'-biphenyl]-4-yl)oxy]-2-methylpropanoic acid
| Molecular Formula | C16H15ClO3 |
|---|---|
| Molecular Weight | 290.07 g/mol |
| LogP | 4.249 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 290.07098 |
| Heavy Atoms | 20 |
| Complexity | 600.624 |
Chemical Identifiers
| CAS Number | 21340-66-9 |
|---|---|
| SMILES | CC(C)(C(=O)O)OC1=CC=C(C=C1)C2=CC=C(C=C2)Cl |
Product Overview
Ici 54856 (CAS 21340-66-9), with molecular formula C16H15ClO3 and molecular weight 290.07 g/mol. IUPAC: 2-[4-(4-chlorophenyl)phenoxy]-2-methylpropanoic acid.
Chemical Property Profile of Ici 54856
Property Insights of Ici 54856
The XLogP value of 4.249 indicates that Ici 54856 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.53 Ų, Ici 54856 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ici 54856 has 1 hydrogen bond donor(s) and 2 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 Ici 54856?
The CAS number of Ici 54856 is 21340-66-9.
What is the molecular formula of Ici 54856?
The molecular formula of Ici 54856 is C16H15ClO3.
What is the molecular weight of Ici 54856?
The molecular weight of Ici 54856 is 290.07 g/mol.
Where can I buy Ici 54856?
You can request a quote for Ici 54856 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ici 54856?
Yes, KEHONG BIO provides custom synthesis services for Ici 54856 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.