Ethyl 2-(4'-carboxybenzamido)-4-aminobenzoate
TL;DR: Ethyl 2-(4'-carboxybenzamido)-4-aminobenzoate (CAS 73626-07-0) is a chemical compound with molecular formula C17H16N2O5 and molecular weight 328.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(5-amino-2-ethoxycarbonylphenyl)carbamoyl]benzoic acid
Also Known As: Acaeba, Ethyl 2-(4'-carboxybenzamido)-4-aminobenzoate, 4-{[5-amino-2-(ethoxycarbonyl)phenyl]carbamoyl}benzoic acid, ethyl 2-(4-carboxybenzamido)-4-aminobenzoate, 4-[(5-amino-2-ethoxycarbonylphenyl)carbamoyl]benzoic acid
| Molecular Formula | C17H16N2O5 |
|---|---|
| Molecular Weight | 328.11 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 119.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 328.10593 |
| Heavy Atoms | 24 |
| Complexity | 474.0 |
Chemical Identifiers
| CAS Number | 73626-07-0 |
|---|---|
| SMILES | CCOC(=O)C1=C(C=C(C=C1)N)NC(=O)C2=CC=C(C=C2)C(=O)O |
| InChIKey | WFZMGMGJYJSKFW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl 2-(4'-carboxybenzamido)-4-aminobenzoate (CAS 73626-07-0), with molecular formula C17H16N2O5 and molecular weight 328.11 g/mol. IUPAC: 4-[(5-amino-2-ethoxycarbonylphenyl)carbamoyl]benzoic acid.
Chemical Property Profile of Ethyl 2-(4'-carboxybenzamido)-4-aminobenzoate
Property Insights of Ethyl 2-(4'-carboxybenzamido)-4-aminobenzoate
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-(4'-carboxybenzamido)-4-aminobenzoate. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-(4'-carboxybenzamido)-4-aminobenzoate. Following Lipinski's Rule of Five, Ethyl 2-(4'-carboxybenzamido)-4-aminobenzoate has 3 hydrogen bond donor(s) and 6 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 Ethyl 2-(4'-carboxybenzamido)-4-aminobenzoate?
The CAS number of Ethyl 2-(4'-carboxybenzamido)-4-aminobenzoate is 73626-07-0.
What is the molecular formula of Ethyl 2-(4'-carboxybenzamido)-4-aminobenzoate?
The molecular formula of Ethyl 2-(4'-carboxybenzamido)-4-aminobenzoate is C17H16N2O5.
What is the molecular weight of Ethyl 2-(4'-carboxybenzamido)-4-aminobenzoate?
The molecular weight of Ethyl 2-(4'-carboxybenzamido)-4-aminobenzoate is 328.11 g/mol.
Where can I buy Ethyl 2-(4'-carboxybenzamido)-4-aminobenzoate?
You can request a quote for Ethyl 2-(4'-carboxybenzamido)-4-aminobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-(4'-carboxybenzamido)-4-aminobenzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-(4'-carboxybenzamido)-4-aminobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.