Ethopabate
TL;DR: Ethopabate (CAS 59-06-3) is a chemical compound with molecular formula C12H15NO4 and molecular weight 237.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-acetamido-2-ethoxybenzoate
Also Known As: Methyl 4-acetamido-2-ethoxybenzoate, Ethyl Pabate, Ethopabat, Mixture Name, Ethopabate (USP)
| Molecular Formula | C12H15NO4 |
|---|---|
| Molecular Weight | 237.10 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 64.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 237.10011 |
| Heavy Atoms | 17 |
| Complexity | 280.0 |
Chemical Identifiers
| CAS Number | 59-06-3 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)NC(=O)C)C(=O)OC |
| InChIKey | GOVWOKSKFSBNGD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethopabate (CAS 59-06-3), with molecular formula C12H15NO4 and molecular weight 237.10 g/mol. IUPAC: methyl 4-acetamido-2-ethoxybenzoate.
Chemical Property Profile of Ethopabate
Property Insights of Ethopabate
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethopabate. The TPSA of 64.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethopabate. Following Lipinski's Rule of Five, Ethopabate 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 Ethopabate?
The CAS number of Ethopabate is 59-06-3.
What is the molecular formula of Ethopabate?
The molecular formula of Ethopabate is C12H15NO4.
What is the molecular weight of Ethopabate?
The molecular weight of Ethopabate is 237.10 g/mol.
Where can I buy Ethopabate?
You can request a quote for Ethopabate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethopabate?
Yes, KEHONG BIO provides custom synthesis services for Ethopabate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.