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Ethyl {[2-(3,4-dimethoxyphenyl)ethyl]amino}(oxo)acetate
TL;DR: Ethyl {[2-(3,4-dimethoxyphenyl)ethyl]amino}(oxo)acetate (CAS 15466-01-0) is a chemical compound with molecular formula C14H19NO5 and molecular weight 281.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxoacetate
Also Known As: ethyl {[2-(3,4-dimethoxyphenyl)ethyl]amino}(oxo)acetate, ethyl 2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxoacetate, ethyl N-[2-(3,4-dimethoxyphenyl)ethyl]oxamate, ethyl{[2-(3,4-dimethoxyphenyl)ethyl]amino}(oxo)acetate, J1.192.023C
| Molecular Formula | C14H19NO5 |
|---|---|
| Molecular Weight | 281.13 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 73.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 281.1263 |
| Heavy Atoms | 20 |
| Complexity | 321.0 |
Chemical Identifiers
| CAS Number | 15466-01-0 |
|---|---|
| SMILES | CCOC(=O)C(=O)NCCC1=CC(=C(C=C1)OC)OC |
| InChIKey | QZQCZJGGHQMDTC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl {[2-(3,4-dimethoxyphenyl)ethyl]amino}(oxo)acetate (CAS 15466-01-0), with molecular formula C14H19NO5 and molecular weight 281.13 g/mol. IUPAC: ethyl 2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxoacetate.
Chemical Property Profile of Ethyl {[2-(3,4-dimethoxyphenyl)ethyl]amino}(oxo)acetate
Property Insights of Ethyl {[2-(3,4-dimethoxyphenyl)ethyl]amino}(oxo)acetate
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl {[2-(3,4-dimethoxyphenyl)ethyl]amino}(oxo)acetate. The TPSA of 73.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl {[2-(3,4-dimethoxyphenyl)ethyl]amino}(oxo)acetate. Following Lipinski's Rule of Five, Ethyl {[2-(3,4-dimethoxyphenyl)ethyl]amino}(oxo)acetate has 1 hydrogen bond donor(s) and 5 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-(3,4-dimethoxyphenyl)ethyl]amino}(oxo)acetate?
The CAS number of Ethyl {[2-(3,4-dimethoxyphenyl)ethyl]amino}(oxo)acetate is 15466-01-0.
What is the molecular formula of Ethyl {[2-(3,4-dimethoxyphenyl)ethyl]amino}(oxo)acetate?
The molecular formula of Ethyl {[2-(3,4-dimethoxyphenyl)ethyl]amino}(oxo)acetate is C14H19NO5.
What is the molecular weight of Ethyl {[2-(3,4-dimethoxyphenyl)ethyl]amino}(oxo)acetate?
The molecular weight of Ethyl {[2-(3,4-dimethoxyphenyl)ethyl]amino}(oxo)acetate is 281.13 g/mol.
Where can I buy Ethyl {[2-(3,4-dimethoxyphenyl)ethyl]amino}(oxo)acetate?
You can request a quote for Ethyl {[2-(3,4-dimethoxyphenyl)ethyl]amino}(oxo)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-(3,4-dimethoxyphenyl)ethyl]amino}(oxo)acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl {[2-(3,4-dimethoxyphenyl)ethyl]amino}(oxo)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.