Methylethyl 2-[3-(4-methoxyphenoxy)-4-oxochromen-7-yloxy]propanoate
TL;DR: Methylethyl 2-[3-(4-methoxyphenoxy)-4-oxochromen-7-yloxy]propanoate (CAS 335210-72-5) is a chemical compound with molecular formula C22H22O7 and molecular weight 398.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 2-[3-(4-methoxyphenoxy)-4-oxochromen-7-yl]oxypropanoate
Also Known As: NPD820, AB01303783-01, methylethyl 2-[3-(4-methoxyphenoxy)-4-oxochromen-7-yloxy]propanoate, isopropyl 2-((3-(4-methoxyphenoxy)-4-oxo-4H-chromen-7-yl)oxy)propanoate, propan-2-yl 2-[3-(4-methoxyphenoxy)-4-oxochromen-7-yl]oxypropanoate
| Molecular Formula | C22H22O7 |
|---|---|
| Molecular Weight | 398.14 g/mol |
| LogP | 4.3128 |
| Topological Polar Surface Area | 84.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 398.13657 |
| Heavy Atoms | 29 |
| Complexity | 1050.939 |
Chemical Identifiers
| CAS Number | 335210-72-5 |
|---|---|
| SMILES | CC(C)OC(=O)C(C)OC1=CC2=C(C=C1)C(=O)C(=CO2)OC3=CC=C(C=C3)OC |
Product Overview
Methylethyl 2-[3-(4-methoxyphenoxy)-4-oxochromen-7-yloxy]propanoate (CAS 335210-72-5), with molecular formula C22H22O7 and molecular weight 398.14 g/mol. IUPAC: propan-2-yl 2-[3-(4-methoxyphenoxy)-4-oxochromen-7-yl]oxypropanoate.
Chemical Property Profile of Methylethyl 2-[3-(4-methoxyphenoxy)-4-oxochromen-7-yloxy]propanoate
Property Insights of Methylethyl 2-[3-(4-methoxyphenoxy)-4-oxochromen-7-yloxy]propanoate
The XLogP value of 4.3128 indicates that Methylethyl 2-[3-(4-methoxyphenoxy)-4-oxochromen-7-yloxy]propanoate 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 Methylethyl 2-[3-(4-methoxyphenoxy)-4-oxochromen-7-yloxy]propanoate. Following Lipinski's Rule of Five, Methylethyl 2-[3-(4-methoxyphenoxy)-4-oxochromen-7-yloxy]propanoate 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 Methylethyl 2-[3-(4-methoxyphenoxy)-4-oxochromen-7-yloxy]propanoate?
The CAS number of Methylethyl 2-[3-(4-methoxyphenoxy)-4-oxochromen-7-yloxy]propanoate is 335210-72-5.
What is the molecular formula of Methylethyl 2-[3-(4-methoxyphenoxy)-4-oxochromen-7-yloxy]propanoate?
The molecular formula of Methylethyl 2-[3-(4-methoxyphenoxy)-4-oxochromen-7-yloxy]propanoate is C22H22O7.
What is the molecular weight of Methylethyl 2-[3-(4-methoxyphenoxy)-4-oxochromen-7-yloxy]propanoate?
The molecular weight of Methylethyl 2-[3-(4-methoxyphenoxy)-4-oxochromen-7-yloxy]propanoate is 398.14 g/mol.
Where can I buy Methylethyl 2-[3-(4-methoxyphenoxy)-4-oxochromen-7-yloxy]propanoate?
You can request a quote for Methylethyl 2-[3-(4-methoxyphenoxy)-4-oxochromen-7-yloxy]propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methylethyl 2-[3-(4-methoxyphenoxy)-4-oxochromen-7-yloxy]propanoate?
Yes, KEHONG BIO provides custom synthesis services for Methylethyl 2-[3-(4-methoxyphenoxy)-4-oxochromen-7-yloxy]propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.