3-(2-Methoxyphenyl)-4-oxo-4H-chromen-7-YL butanoate
TL;DR: 3-(2-Methoxyphenyl)-4-oxo-4H-chromen-7-YL butanoate (CAS 303121-47-3) is a chemical compound with molecular formula C20H18O5 and molecular weight 338.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(2-methoxyphenyl)-4-oxochromen-7-yl] butanoate
Also Known As: BIM-0001198.P001, AB00285080-02, [3-(2-methoxyphenyl)-4-oxochromen-7-yl] butanoate, 3-(2-methoxyphenyl)-4-oxo-4H-chromen-7-yl butyrate, 3-(2-METHOXYPHENYL)-4-OXO-4H-CHROMEN-7-YL BUTANOATE
| Molecular Formula | C20H18O5 |
|---|---|
| Molecular Weight | 338.12 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 338.11542 |
| Heavy Atoms | 25 |
| Complexity | 526.0 |
Chemical Identifiers
| CAS Number | 303121-47-3 |
|---|---|
| SMILES | CCCC(=O)OC1=CC2=C(C=C1)C(=O)C(=CO2)C3=CC=CC=C3OC |
| InChIKey | LALBBQUKLKLXNN-UHFFFAOYSA-N |
Product Overview
3-(2-Methoxyphenyl)-4-oxo-4H-chromen-7-YL butanoate (CAS 303121-47-3), with molecular formula C20H18O5 and molecular weight 338.12 g/mol. IUPAC: [3-(2-methoxyphenyl)-4-oxochromen-7-yl] butanoate.
Chemical Property Profile of 3-(2-Methoxyphenyl)-4-oxo-4H-chromen-7-YL butanoate
Property Insights of 3-(2-Methoxyphenyl)-4-oxo-4H-chromen-7-YL butanoate
The XLogP value of 3.7 indicates that 3-(2-Methoxyphenyl)-4-oxo-4H-chromen-7-YL butanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2-Methoxyphenyl)-4-oxo-4H-chromen-7-YL butanoate. Following Lipinski's Rule of Five, 3-(2-Methoxyphenyl)-4-oxo-4H-chromen-7-YL butanoate has 0 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 3-(2-Methoxyphenyl)-4-oxo-4H-chromen-7-YL butanoate?
The CAS number of 3-(2-Methoxyphenyl)-4-oxo-4H-chromen-7-YL butanoate is 303121-47-3.
What is the molecular formula of 3-(2-Methoxyphenyl)-4-oxo-4H-chromen-7-YL butanoate?
The molecular formula of 3-(2-Methoxyphenyl)-4-oxo-4H-chromen-7-YL butanoate is C20H18O5.
What is the molecular weight of 3-(2-Methoxyphenyl)-4-oxo-4H-chromen-7-YL butanoate?
The molecular weight of 3-(2-Methoxyphenyl)-4-oxo-4H-chromen-7-YL butanoate is 338.12 g/mol.
Where can I buy 3-(2-Methoxyphenyl)-4-oxo-4H-chromen-7-YL butanoate?
You can request a quote for 3-(2-Methoxyphenyl)-4-oxo-4H-chromen-7-YL butanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-Methoxyphenyl)-4-oxo-4H-chromen-7-YL butanoate?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-Methoxyphenyl)-4-oxo-4H-chromen-7-YL butanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.