![4-{5-[(2,4-dimethoxyphenyl)methylene]-2,4-dioxo-1,3-thiazolidin-3-yl}butanoic acid structure](/static/products/845/845653-16-9.png)
4-{5-[(2,4-dimethoxyphenyl)methylene]-2,4-dioxo-1,3-thiazolidin-3-yl}butanoic acid
TL;DR: 4-{5-[(2,4-dimethoxyphenyl)methylene]-2,4-dioxo-1,3-thiazolidin-3-yl}butanoic acid (CAS 845653-16-9) is a chemical compound with molecular formula C16H17NO6S and molecular weight 351.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(5Z)-5-[(2,4-dimethoxyphenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]butanoic acid
Also Known As: 4-{5-[(2,4-dimethoxyphenyl)methylene]-2,4-dioxo-1,3-thiazolidin-3-yl}butanoic acid, (Z)-4-(5-(2,4-dimethoxybenzylidene)-2,4-dioxothiazolidin-3-yl)butanoic acid, 4-[(5Z)-5-(2,4-dimethoxybenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]butanoic acid, 4-[5-[(2,4-dimethoxyphenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]butanoic Acid, 4-[(5Z)-5-[(2,4-dimethoxyphenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]butanoic acid
| Molecular Formula | C16H17NO6S |
|---|---|
| Molecular Weight | 351.08 g/mol |
| LogP | 2.6049 |
| Topological Polar Surface Area | 93.14 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 351.07767 |
| Heavy Atoms | 24 |
| Complexity | 699.8081 |
Chemical Identifiers
| CAS Number | 845653-16-9 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)/C=C\2/C(=O)N(C(=O)S2)CCCC(=O)O)OC |
Product Overview
4-{5-[(2,4-dimethoxyphenyl)methylene]-2,4-dioxo-1,3-thiazolidin-3-yl}butanoic acid (CAS 845653-16-9), with molecular formula C16H17NO6S and molecular weight 351.08 g/mol. IUPAC: 4-[(5Z)-5-[(2,4-dimethoxyphenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]butanoic acid.
Chemical Property Profile of 4-{5-[(2,4-dimethoxyphenyl)methylene]-2,4-dioxo-1,3-thiazolidin-3-yl}butanoic acid
Property Insights of 4-{5-[(2,4-dimethoxyphenyl)methylene]-2,4-dioxo-1,3-thiazolidin-3-yl}butanoic acid
The XLogP value of 2.6049 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-{5-[(2,4-dimethoxyphenyl)methylene]-2,4-dioxo-1,3-thiazolidin-3-yl}butanoic acid. The TPSA of 93.14 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-{5-[(2,4-dimethoxyphenyl)methylene]-2,4-dioxo-1,3-thiazolidin-3-yl}butanoic acid. Following Lipinski's Rule of Five, 4-{5-[(2,4-dimethoxyphenyl)methylene]-2,4-dioxo-1,3-thiazolidin-3-yl}butanoic 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 4-{5-[(2,4-dimethoxyphenyl)methylene]-2,4-dioxo-1,3-thiazolidin-3-yl}butanoic acid?
The CAS number of 4-{5-[(2,4-dimethoxyphenyl)methylene]-2,4-dioxo-1,3-thiazolidin-3-yl}butanoic acid is 845653-16-9.
What is the molecular formula of 4-{5-[(2,4-dimethoxyphenyl)methylene]-2,4-dioxo-1,3-thiazolidin-3-yl}butanoic acid?
The molecular formula of 4-{5-[(2,4-dimethoxyphenyl)methylene]-2,4-dioxo-1,3-thiazolidin-3-yl}butanoic acid is C16H17NO6S.
What is the molecular weight of 4-{5-[(2,4-dimethoxyphenyl)methylene]-2,4-dioxo-1,3-thiazolidin-3-yl}butanoic acid?
The molecular weight of 4-{5-[(2,4-dimethoxyphenyl)methylene]-2,4-dioxo-1,3-thiazolidin-3-yl}butanoic acid is 351.08 g/mol.
Where can I buy 4-{5-[(2,4-dimethoxyphenyl)methylene]-2,4-dioxo-1,3-thiazolidin-3-yl}butanoic acid?
You can request a quote for 4-{5-[(2,4-dimethoxyphenyl)methylene]-2,4-dioxo-1,3-thiazolidin-3-yl}butanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-{5-[(2,4-dimethoxyphenyl)methylene]-2,4-dioxo-1,3-thiazolidin-3-yl}butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-{5-[(2,4-dimethoxyphenyl)methylene]-2,4-dioxo-1,3-thiazolidin-3-yl}butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.