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Ethyl 2-[(4-chlorobenzoyl)amino]acetate
TL;DR: Ethyl 2-[(4-chlorobenzoyl)amino]acetate (CAS 39735-52-9) is a chemical compound with molecular formula C11H12ClNO3 and molecular weight 241.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(4-chlorobenzoyl)amino]acetate
Also Known As: ethyl 2-[(4-chlorobenzoyl)amino]acetate, Ethyl 2-(4-chlorobenzamido)acetate, ethyl 2-[(4-chlorophenyl)formamido]acetate, Maybridge1_001874, ETHYL 4-CHLOROHIPPURATE
| Molecular Formula | C11H12ClNO3 |
|---|---|
| Molecular Weight | 241.05 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 241.05057 |
| Heavy Atoms | 16 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 39735-52-9 |
|---|---|
| SMILES | CCOC(=O)CNC(=O)C1=CC=C(C=C1)Cl |
| InChIKey | XYVZUPHHGNHQHN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl 2-[(4-chlorobenzoyl)amino]acetate (CAS 39735-52-9), with molecular formula C11H12ClNO3 and molecular weight 241.05 g/mol. IUPAC: ethyl 2-[(4-chlorobenzoyl)amino]acetate.
Chemical Property Profile of Ethyl 2-[(4-chlorobenzoyl)amino]acetate
Property Insights of Ethyl 2-[(4-chlorobenzoyl)amino]acetate
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-[(4-chlorobenzoyl)amino]acetate. With a topological polar surface area (TPSA) of 55.4 Ų, Ethyl 2-[(4-chlorobenzoyl)amino]acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-[(4-chlorobenzoyl)amino]acetate 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 2-[(4-chlorobenzoyl)amino]acetate?
The CAS number of Ethyl 2-[(4-chlorobenzoyl)amino]acetate is 39735-52-9.
What is the molecular formula of Ethyl 2-[(4-chlorobenzoyl)amino]acetate?
The molecular formula of Ethyl 2-[(4-chlorobenzoyl)amino]acetate is C11H12ClNO3.
What is the molecular weight of Ethyl 2-[(4-chlorobenzoyl)amino]acetate?
The molecular weight of Ethyl 2-[(4-chlorobenzoyl)amino]acetate is 241.05 g/mol.
Where can I buy Ethyl 2-[(4-chlorobenzoyl)amino]acetate?
You can request a quote for Ethyl 2-[(4-chlorobenzoyl)amino]acetate 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-chlorobenzoyl)amino]acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-[(4-chlorobenzoyl)amino]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.