2-(Ethoxycarbonyl)-3-(4-methoxyphenyl)-4-oxochromen-7-yl acetate
TL;DR: 2-(Ethoxycarbonyl)-3-(4-methoxyphenyl)-4-oxochromen-7-yl acetate (CAS 610758-65-1) is a chemical compound with molecular formula C21H18O7 and molecular weight 382.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 7-acetyloxy-3-(4-methoxyphenyl)-4-oxochromene-2-carboxylate
Also Known As: AB01280273-01, 2-(ethoxycarbonyl)-3-(4-methoxyphenyl)-4-oxochromen-7-yl acetate, ethyl 7-acetyloxy-3-(4-methoxyphenyl)-4-oxochromene-2-carboxylate, ethyl 7-(acetyloxy)-3-(4-methoxyphenyl)-4-oxo-4H-chromene-2-carboxylate, ethyl 7-acetoxy-3-(4-methoxyphenyl)-4-oxo-4H-chromene-2-carboxylate
| Molecular Formula | C21H18O7 |
|---|---|
| Molecular Weight | 382.11 g/mol |
| LogP | 3.5706 |
| Topological Polar Surface Area | 92.04 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 382.10526 |
| Heavy Atoms | 28 |
| Complexity | 1094.1775 |
Chemical Identifiers
| CAS Number | 610758-65-1 |
|---|---|
| SMILES | CCOC(=O)C1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)C)C3=CC=C(C=C3)OC |
Product Overview
2-(Ethoxycarbonyl)-3-(4-methoxyphenyl)-4-oxochromen-7-yl acetate (CAS 610758-65-1), with molecular formula C21H18O7 and molecular weight 382.11 g/mol. IUPAC: ethyl 7-acetyloxy-3-(4-methoxyphenyl)-4-oxochromene-2-carboxylate.
Chemical Property Profile of 2-(Ethoxycarbonyl)-3-(4-methoxyphenyl)-4-oxochromen-7-yl acetate
Property Insights of 2-(Ethoxycarbonyl)-3-(4-methoxyphenyl)-4-oxochromen-7-yl acetate
The XLogP value of 3.5706 indicates that 2-(Ethoxycarbonyl)-3-(4-methoxyphenyl)-4-oxochromen-7-yl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.04 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Ethoxycarbonyl)-3-(4-methoxyphenyl)-4-oxochromen-7-yl acetate. Following Lipinski's Rule of Five, 2-(Ethoxycarbonyl)-3-(4-methoxyphenyl)-4-oxochromen-7-yl 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 2-(Ethoxycarbonyl)-3-(4-methoxyphenyl)-4-oxochromen-7-yl acetate?
The CAS number of 2-(Ethoxycarbonyl)-3-(4-methoxyphenyl)-4-oxochromen-7-yl acetate is 610758-65-1.
What is the molecular formula of 2-(Ethoxycarbonyl)-3-(4-methoxyphenyl)-4-oxochromen-7-yl acetate?
The molecular formula of 2-(Ethoxycarbonyl)-3-(4-methoxyphenyl)-4-oxochromen-7-yl acetate is C21H18O7.
What is the molecular weight of 2-(Ethoxycarbonyl)-3-(4-methoxyphenyl)-4-oxochromen-7-yl acetate?
The molecular weight of 2-(Ethoxycarbonyl)-3-(4-methoxyphenyl)-4-oxochromen-7-yl acetate is 382.11 g/mol.
Where can I buy 2-(Ethoxycarbonyl)-3-(4-methoxyphenyl)-4-oxochromen-7-yl acetate?
You can request a quote for 2-(Ethoxycarbonyl)-3-(4-methoxyphenyl)-4-oxochromen-7-yl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Ethoxycarbonyl)-3-(4-methoxyphenyl)-4-oxochromen-7-yl acetate?
Yes, KEHONG BIO provides custom synthesis services for 2-(Ethoxycarbonyl)-3-(4-methoxyphenyl)-4-oxochromen-7-yl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.