![Ethyl 4-{[(2-chloro-6-fluorophenyl)acetyl]amino}benzoate structure](/static/products/7109/710987-86-3.webp)
Ethyl 4-{[(2-chloro-6-fluorophenyl)acetyl]amino}benzoate
TL;DR: Ethyl 4-{[(2-chloro-6-fluorophenyl)acetyl]amino}benzoate (CAS 710987-86-3) is a chemical compound with molecular formula C17H15ClFNO3 and molecular weight 335.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[[2-(2-chloro-6-fluorophenyl)acetyl]amino]benzoate
Also Known As: ethyl 4-(2-(2-chloro-6-fluorophenyl)acetamido)benzoate, ethyl 4-[2-(2-chloro-6-fluorophenyl)acetylamino]benzoate, ethyl 4-{[(2-chloro-6-fluorophenyl)acetyl]amino}benzoate, ethyl 4-[[2-(2-chloro-6-fluorophenyl)acetyl]amino]benzoate, ETHYL 4-[2-(2-CHLORO-6-FLUOROPHENYL)ACETAMIDO]BENZOATE
| Molecular Formula | C17H15ClFNO3 |
|---|---|
| Molecular Weight | 335.07 g/mol |
| LogP | 3.837 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 335.07245 |
| Heavy Atoms | 23 |
| Complexity | 696.02844 |
Chemical Identifiers
| CAS Number | 710987-86-3 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=O)CC2=C(C=CC=C2Cl)F |
Product Overview
Ethyl 4-{[(2-chloro-6-fluorophenyl)acetyl]amino}benzoate (CAS 710987-86-3), with molecular formula C17H15ClFNO3 and molecular weight 335.07 g/mol. IUPAC: ethyl 4-[[2-(2-chloro-6-fluorophenyl)acetyl]amino]benzoate.
Chemical Property Profile of Ethyl 4-{[(2-chloro-6-fluorophenyl)acetyl]amino}benzoate
Property Insights of Ethyl 4-{[(2-chloro-6-fluorophenyl)acetyl]amino}benzoate
The XLogP value of 3.837 indicates that Ethyl 4-{[(2-chloro-6-fluorophenyl)acetyl]amino}benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, Ethyl 4-{[(2-chloro-6-fluorophenyl)acetyl]amino}benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 4-{[(2-chloro-6-fluorophenyl)acetyl]amino}benzoate has 1 hydrogen bond donor(s) and 3 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-{[(2-chloro-6-fluorophenyl)acetyl]amino}benzoate?
The CAS number of Ethyl 4-{[(2-chloro-6-fluorophenyl)acetyl]amino}benzoate is 710987-86-3.
What is the molecular formula of Ethyl 4-{[(2-chloro-6-fluorophenyl)acetyl]amino}benzoate?
The molecular formula of Ethyl 4-{[(2-chloro-6-fluorophenyl)acetyl]amino}benzoate is C17H15ClFNO3.
What is the molecular weight of Ethyl 4-{[(2-chloro-6-fluorophenyl)acetyl]amino}benzoate?
The molecular weight of Ethyl 4-{[(2-chloro-6-fluorophenyl)acetyl]amino}benzoate is 335.07 g/mol.
Where can I buy Ethyl 4-{[(2-chloro-6-fluorophenyl)acetyl]amino}benzoate?
You can request a quote for Ethyl 4-{[(2-chloro-6-fluorophenyl)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-{[(2-chloro-6-fluorophenyl)acetyl]amino}benzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-{[(2-chloro-6-fluorophenyl)acetyl]amino}benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.