![2-[4-[[3-[(4-Fluorophenyl)methyl]-2,4-dioxo-5-thiazolidinylidene]methyl]-2-methoxyphenoxy]acetic acid structure](/static/products/4288/428822-94-0.webp)
2-[4-[[3-[(4-Fluorophenyl)methyl]-2,4-dioxo-5-thiazolidinylidene]methyl]-2-methoxyphenoxy]acetic acid
TL;DR: 2-[4-[[3-[(4-Fluorophenyl)methyl]-2,4-dioxo-5-thiazolidinylidene]methyl]-2-methoxyphenoxy]acetic acid (CAS 428822-94-0) is a chemical compound with molecular formula C20H16FNO6S and molecular weight 417.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[[3-[(4-fluorophenyl)methyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl]-2-methoxyphenoxy]acetic acid
Also Known As: 2-[4-[[3-[(4-Fluorophenyl)methyl]-2,4-dioxo-5-thiazolidinylidene]methyl]-2-methoxyphenoxy]acetic acid, [4-({3-[(4-Fluorophenyl)methyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene}methyl)-2-methoxyphenoxy]acetic acid, 2-[4-[[3-[(4-fluorophenyl)methyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl]-2-methoxyphenoxy]acetic acid
| Molecular Formula | C20H16FNO6S |
|---|---|
| Molecular Weight | 417.07 g/mol |
| LogP | 3.5342 |
| Topological Polar Surface Area | 93.14 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 417.06824 |
| Heavy Atoms | 29 |
| Complexity | 988.966 |
Chemical Identifiers
| CAS Number | 428822-94-0 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C=C2C(=O)N(C(=O)S2)CC3=CC=C(C=C3)F)OCC(=O)O |
Product Overview
2-[4-[[3-[(4-Fluorophenyl)methyl]-2,4-dioxo-5-thiazolidinylidene]methyl]-2-methoxyphenoxy]acetic acid (CAS 428822-94-0), with molecular formula C20H16FNO6S and molecular weight 417.07 g/mol. IUPAC: 2-[4-[[3-[(4-fluorophenyl)methyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl]-2-methoxyphenoxy]acetic acid.
Chemical Property Profile of 2-[4-[[3-[(4-Fluorophenyl)methyl]-2,4-dioxo-5-thiazolidinylidene]methyl]-2-methoxyphenoxy]acetic acid
Property Insights of 2-[4-[[3-[(4-Fluorophenyl)methyl]-2,4-dioxo-5-thiazolidinylidene]methyl]-2-methoxyphenoxy]acetic acid
The XLogP value of 3.5342 indicates that 2-[4-[[3-[(4-Fluorophenyl)methyl]-2,4-dioxo-5-thiazolidinylidene]methyl]-2-methoxyphenoxy]acetic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.14 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[4-[[3-[(4-Fluorophenyl)methyl]-2,4-dioxo-5-thiazolidinylidene]methyl]-2-methoxyphenoxy]acetic acid. Following Lipinski's Rule of Five, 2-[4-[[3-[(4-Fluorophenyl)methyl]-2,4-dioxo-5-thiazolidinylidene]methyl]-2-methoxyphenoxy]acetic acid has 1 hydrogen bond donor(s) and 6 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-[4-[[3-[(4-Fluorophenyl)methyl]-2,4-dioxo-5-thiazolidinylidene]methyl]-2-methoxyphenoxy]acetic acid?
The CAS number of 2-[4-[[3-[(4-Fluorophenyl)methyl]-2,4-dioxo-5-thiazolidinylidene]methyl]-2-methoxyphenoxy]acetic acid is 428822-94-0.
What is the molecular formula of 2-[4-[[3-[(4-Fluorophenyl)methyl]-2,4-dioxo-5-thiazolidinylidene]methyl]-2-methoxyphenoxy]acetic acid?
The molecular formula of 2-[4-[[3-[(4-Fluorophenyl)methyl]-2,4-dioxo-5-thiazolidinylidene]methyl]-2-methoxyphenoxy]acetic acid is C20H16FNO6S.
What is the molecular weight of 2-[4-[[3-[(4-Fluorophenyl)methyl]-2,4-dioxo-5-thiazolidinylidene]methyl]-2-methoxyphenoxy]acetic acid?
The molecular weight of 2-[4-[[3-[(4-Fluorophenyl)methyl]-2,4-dioxo-5-thiazolidinylidene]methyl]-2-methoxyphenoxy]acetic acid is 417.07 g/mol.
Where can I buy 2-[4-[[3-[(4-Fluorophenyl)methyl]-2,4-dioxo-5-thiazolidinylidene]methyl]-2-methoxyphenoxy]acetic acid?
You can request a quote for 2-[4-[[3-[(4-Fluorophenyl)methyl]-2,4-dioxo-5-thiazolidinylidene]methyl]-2-methoxyphenoxy]acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[4-[[3-[(4-Fluorophenyl)methyl]-2,4-dioxo-5-thiazolidinylidene]methyl]-2-methoxyphenoxy]acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[4-[[3-[(4-Fluorophenyl)methyl]-2,4-dioxo-5-thiazolidinylidene]methyl]-2-methoxyphenoxy]acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.