ethyl 2-{[2-(2,3-dimethoxyphenyl)-4-oxo-4H-chromen-3-yl]oxy}acetate
TL;DR: ethyl 2-{[2-(2,3-dimethoxyphenyl)-4-oxo-4H-chromen-3-yl]oxy}acetate (CAS 331459-67-7) is a chemical compound with molecular formula C21H20O7 and molecular weight 384.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[2-(2,3-dimethoxyphenyl)-4-oxochromen-3-yl]oxyacetate
Also Known As: ethyl 2-{[2-(2,3-dimethoxyphenyl)-4-oxo-4H-chromen-3-yl]oxy}acetate, AA-768/30961006, ethyl 2-[2-(2,3-dimethoxyphenyl)-4-oxochromen-3-yl]oxyacetate, ethyl {[2-(2,3-dimethoxyphenyl)-4-oxo-4H-chromen-3-yl]oxy}acetate, ethyl 2-[2-(2,3-dimethoxyphenyl)-4-oxo-chromen-3-yl]oxyacetate
| Molecular Formula | C21H20O7 |
|---|---|
| Molecular Weight | 384.12 g/mol |
| LogP | 3.4191 |
| Topological Polar Surface Area | 84.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 384.1209 |
| Heavy Atoms | 28 |
| Complexity | 1052.2937 |
Chemical Identifiers
| CAS Number | 331459-67-7 |
|---|---|
| SMILES | CCOC(=O)COC1=C(OC2=CC=CC=C2C1=O)C3=C(C(=CC=C3)OC)OC |
Product Overview
ethyl 2-{[2-(2,3-dimethoxyphenyl)-4-oxo-4H-chromen-3-yl]oxy}acetate (CAS 331459-67-7), with molecular formula C21H20O7 and molecular weight 384.12 g/mol. IUPAC: ethyl 2-[2-(2,3-dimethoxyphenyl)-4-oxochromen-3-yl]oxyacetate.
Chemical Property Profile of ethyl 2-{[2-(2,3-dimethoxyphenyl)-4-oxo-4H-chromen-3-yl]oxy}acetate
Property Insights of ethyl 2-{[2-(2,3-dimethoxyphenyl)-4-oxo-4H-chromen-3-yl]oxy}acetate
The XLogP value of 3.4191 indicates that ethyl 2-{[2-(2,3-dimethoxyphenyl)-4-oxo-4H-chromen-3-yl]oxy}acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.2 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 2-{[2-(2,3-dimethoxyphenyl)-4-oxo-4H-chromen-3-yl]oxy}acetate. Following Lipinski's Rule of Five, ethyl 2-{[2-(2,3-dimethoxyphenyl)-4-oxo-4H-chromen-3-yl]oxy}acetate has 0 hydrogen bond donor(s) and 7 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-{[2-(2,3-dimethoxyphenyl)-4-oxo-4H-chromen-3-yl]oxy}acetate?
The CAS number of ethyl 2-{[2-(2,3-dimethoxyphenyl)-4-oxo-4H-chromen-3-yl]oxy}acetate is 331459-67-7.
What is the molecular formula of ethyl 2-{[2-(2,3-dimethoxyphenyl)-4-oxo-4H-chromen-3-yl]oxy}acetate?
The molecular formula of ethyl 2-{[2-(2,3-dimethoxyphenyl)-4-oxo-4H-chromen-3-yl]oxy}acetate is C21H20O7.
What is the molecular weight of ethyl 2-{[2-(2,3-dimethoxyphenyl)-4-oxo-4H-chromen-3-yl]oxy}acetate?
The molecular weight of ethyl 2-{[2-(2,3-dimethoxyphenyl)-4-oxo-4H-chromen-3-yl]oxy}acetate is 384.12 g/mol.
Where can I buy ethyl 2-{[2-(2,3-dimethoxyphenyl)-4-oxo-4H-chromen-3-yl]oxy}acetate?
You can request a quote for ethyl 2-{[2-(2,3-dimethoxyphenyl)-4-oxo-4H-chromen-3-yl]oxy}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-{[2-(2,3-dimethoxyphenyl)-4-oxo-4H-chromen-3-yl]oxy}acetate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 2-{[2-(2,3-dimethoxyphenyl)-4-oxo-4H-chromen-3-yl]oxy}acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.