![Ethyl 4-chloro-3-[(2-fluorobenzoyl)amino]benzoate structure](/static/products/791/791801-85-9.png)
Ethyl 4-chloro-3-[(2-fluorobenzoyl)amino]benzoate
TL;DR: Ethyl 4-chloro-3-[(2-fluorobenzoyl)amino]benzoate (CAS 791801-85-9) is a chemical compound with molecular formula C16H13ClFNO3 and molecular weight 321.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-chloro-3-[(2-fluorobenzoyl)amino]benzoate
Also Known As: ethyl 4-chloro-3-[(2-fluorobenzoyl)amino]benzoate, AN-652/43163050
| Molecular Formula | C16H13ClFNO3 |
|---|---|
| Molecular Weight | 321.06 g/mol |
| LogP | 3.9081 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 321.0568 |
| Heavy Atoms | 22 |
| Complexity | 718.2872 |
Chemical Identifiers
| CAS Number | 791801-85-9 |
|---|---|
| SMILES | CCOC(=O)C1=CC(=C(C=C1)Cl)NC(=O)C2=CC=CC=C2F |
Product Overview
Ethyl 4-chloro-3-[(2-fluorobenzoyl)amino]benzoate (CAS 791801-85-9), with molecular formula C16H13ClFNO3 and molecular weight 321.06 g/mol. IUPAC: ethyl 4-chloro-3-[(2-fluorobenzoyl)amino]benzoate.
Chemical Property Profile of Ethyl 4-chloro-3-[(2-fluorobenzoyl)amino]benzoate
Property Insights of Ethyl 4-chloro-3-[(2-fluorobenzoyl)amino]benzoate
The XLogP value of 3.9081 indicates that Ethyl 4-chloro-3-[(2-fluorobenzoyl)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-chloro-3-[(2-fluorobenzoyl)amino]benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 4-chloro-3-[(2-fluorobenzoyl)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-chloro-3-[(2-fluorobenzoyl)amino]benzoate?
The CAS number of Ethyl 4-chloro-3-[(2-fluorobenzoyl)amino]benzoate is 791801-85-9.
What is the molecular formula of Ethyl 4-chloro-3-[(2-fluorobenzoyl)amino]benzoate?
The molecular formula of Ethyl 4-chloro-3-[(2-fluorobenzoyl)amino]benzoate is C16H13ClFNO3.
What is the molecular weight of Ethyl 4-chloro-3-[(2-fluorobenzoyl)amino]benzoate?
The molecular weight of Ethyl 4-chloro-3-[(2-fluorobenzoyl)amino]benzoate is 321.06 g/mol.
Where can I buy Ethyl 4-chloro-3-[(2-fluorobenzoyl)amino]benzoate?
You can request a quote for Ethyl 4-chloro-3-[(2-fluorobenzoyl)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-chloro-3-[(2-fluorobenzoyl)amino]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-chloro-3-[(2-fluorobenzoyl)amino]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.