4'-Hydroxydiclofenac
TL;DR: 4'-Hydroxydiclofenac (CAS 64118-84-9) is a chemical compound with molecular formula C14H11Cl2NO3 and molecular weight 311.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(2,6-dichloro-4-hydroxyanilino)phenyl]acetic acid
Also Known As: 4'-Hydroxydiclofenac, 4'-Hydroxy Diclofenac, 4-hydroxy diclofenac, 4′-OHD, 4-Hydroxydiclofenac
| Molecular Formula | C14H11Cl2NO3 |
|---|---|
| Molecular Weight | 311.01 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 69.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 311.0116 |
| Heavy Atoms | 20 |
| Complexity | 330.0 |
Chemical Identifiers
| CAS Number | 64118-84-9 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CC(=O)O)NC2=C(C=C(C=C2Cl)O)Cl |
| InChIKey | KGVXVPRLBMWZLG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4'-Hydroxydiclofenac (CAS 64118-84-9), with molecular formula C14H11Cl2NO3 and molecular weight 311.01 g/mol. IUPAC: 2-[2-(2,6-dichloro-4-hydroxyanilino)phenyl]acetic acid.
Chemical Property Profile of 4'-Hydroxydiclofenac
Property Insights of 4'-Hydroxydiclofenac
The XLogP value of 3.7 indicates that 4'-Hydroxydiclofenac is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4'-Hydroxydiclofenac. Following Lipinski's Rule of Five, 4'-Hydroxydiclofenac has 3 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 4'-Hydroxydiclofenac?
The CAS number of 4'-Hydroxydiclofenac is 64118-84-9.
What is the molecular formula of 4'-Hydroxydiclofenac?
The molecular formula of 4'-Hydroxydiclofenac is C14H11Cl2NO3.
What is the molecular weight of 4'-Hydroxydiclofenac?
The molecular weight of 4'-Hydroxydiclofenac is 311.01 g/mol.
Where can I buy 4'-Hydroxydiclofenac?
You can request a quote for 4'-Hydroxydiclofenac directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4'-Hydroxydiclofenac?
Yes, KEHONG BIO provides custom synthesis services for 4'-Hydroxydiclofenac and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.