![Ethyl 4-{[(4-nitrophenoxy)acetyl]amino}benzoate structure](/static/products/446/446269-07-4.png)
Ethyl 4-{[(4-nitrophenoxy)acetyl]amino}benzoate
TL;DR: Ethyl 4-{[(4-nitrophenoxy)acetyl]amino}benzoate (CAS 446269-07-4) is a chemical compound with molecular formula C17H16N2O6 and molecular weight 344.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[[2-(4-nitrophenoxy)acetyl]amino]benzoate
Also Known As: ethyl 4-{[(4-nitrophenoxy)acetyl]amino}benzoate, ethyl 4-[[2-(4-nitrophenoxy)acetyl]amino]benzoate, ethyl 4-[({4-nitrophenoxy}acetyl)amino]benzoate, ethyl 4-[2-(4-nitrophenoxy)acetylamino]benzoate, AN-329/13289019
| Molecular Formula | C17H16N2O6 |
|---|---|
| Molecular Weight | 344.10 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 110.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 344.10083 |
| Heavy Atoms | 25 |
| Complexity | 462.0 |
Chemical Identifiers
| CAS Number | 446269-07-4 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=O)COC2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | WEDMLRBNWRSWIR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl 4-{[(4-nitrophenoxy)acetyl]amino}benzoate (CAS 446269-07-4), with molecular formula C17H16N2O6 and molecular weight 344.10 g/mol. IUPAC: ethyl 4-[[2-(4-nitrophenoxy)acetyl]amino]benzoate.
Chemical Property Profile of Ethyl 4-{[(4-nitrophenoxy)acetyl]amino}benzoate
Property Insights of Ethyl 4-{[(4-nitrophenoxy)acetyl]amino}benzoate
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 4-{[(4-nitrophenoxy)acetyl]amino}benzoate. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-{[(4-nitrophenoxy)acetyl]amino}benzoate. Following Lipinski's Rule of Five, Ethyl 4-{[(4-nitrophenoxy)acetyl]amino}benzoate has 1 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 4-{[(4-nitrophenoxy)acetyl]amino}benzoate?
The CAS number of Ethyl 4-{[(4-nitrophenoxy)acetyl]amino}benzoate is 446269-07-4.
What is the molecular formula of Ethyl 4-{[(4-nitrophenoxy)acetyl]amino}benzoate?
The molecular formula of Ethyl 4-{[(4-nitrophenoxy)acetyl]amino}benzoate is C17H16N2O6.
What is the molecular weight of Ethyl 4-{[(4-nitrophenoxy)acetyl]amino}benzoate?
The molecular weight of Ethyl 4-{[(4-nitrophenoxy)acetyl]amino}benzoate is 344.10 g/mol.
Where can I buy Ethyl 4-{[(4-nitrophenoxy)acetyl]amino}benzoate?
You can request a quote for Ethyl 4-{[(4-nitrophenoxy)acetyl]amino}benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-{[(4-nitrophenoxy)acetyl]amino}benzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-{[(4-nitrophenoxy)acetyl]amino}benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.