Econazole sulfosalicylate
TL;DR: Econazole sulfosalicylate (CAS 118308-71-7) is a chemical compound with molecular formula C25H21Cl3N2O7S and molecular weight 598.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-[(4-chlorophenyl)methoxy]-2-(2,4-dichlorophenyl)ethyl]imidazole;2-hydroxy-5-sulfobenzoic acid
Also Known As: Econazole sulfosalicylate, E-SSA, 2-hydroxy-5-sulfo-benzoic acid, ECONAZOLE SULFOSALICYLATE [WHO-DD], 1-[2-[(4-chlorophenyl)methoxy]-2-(2,4-dichlorophenyl)ethyl]imidazole; 2-hydroxy-5-sulfo-benzoic acid
| Molecular Formula | C25H21Cl3N2O7S |
|---|---|
| Molecular Weight | 598.01 g/mol |
| LogP | 6.1385 |
| Topological Polar Surface Area | 147.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 598.0135 |
| Heavy Atoms | 38 |
| Complexity | 695.0 |
Chemical Identifiers
| CAS Number | 118308-71-7 |
|---|---|
| SMILES | C1=CC(=CC=C1COC(CN2C=CN=C2)C3=C(C=C(C=C3)Cl)Cl)Cl.C1=CC(=C(C=C1S(=O)(=O)O)C(=O)O)O |
| InChIKey | WJRNYYWHDHVDCF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Econazole sulfosalicylate (CAS 118308-71-7), with molecular formula C25H21Cl3N2O7S and molecular weight 598.01 g/mol. IUPAC: 1-[2-[(4-chlorophenyl)methoxy]-2-(2,4-dichlorophenyl)ethyl]imidazole;2-hydroxy-5-sulfobenzoic acid.
Chemical Property Profile of Econazole sulfosalicylate
Property Insights of Econazole sulfosalicylate
The XLogP value of 6.1385 indicates that Econazole sulfosalicylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 147.0 Ų indicates high polarity, suggesting Econazole sulfosalicylate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Econazole sulfosalicylate has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Econazole sulfosalicylate?
The CAS number of Econazole sulfosalicylate is 118308-71-7.
What is the molecular formula of Econazole sulfosalicylate?
The molecular formula of Econazole sulfosalicylate is C25H21Cl3N2O7S.
What is the molecular weight of Econazole sulfosalicylate?
The molecular weight of Econazole sulfosalicylate is 598.01 g/mol.
Where can I buy Econazole sulfosalicylate?
You can request a quote for Econazole sulfosalicylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Econazole sulfosalicylate?
Yes, KEHONG BIO provides custom synthesis services for Econazole sulfosalicylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.