3-(2-(3,4-Dimethoxyphenyl)ethyl)-2-((4-methoxyphenyl)imino)-4-oxo-5-thiazolidineacetic acid
TL;DR: 3-(2-(3,4-Dimethoxyphenyl)ethyl)-2-((4-methoxyphenyl)imino)-4-oxo-5-thiazolidineacetic acid (CAS 67931-69-5) is a chemical compound with molecular formula C22H24N2O6S and molecular weight 444.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-methoxyphenyl)imino-4-oxo-1,3-thiazolidin-5-yl]acetic acid
Also Known As: 3-(2-(3,4-Dimethoxyphenyl)ethyl)-2-((4-methoxyphenyl)imino)-4-oxo-5-thiazolidineacetic acid, 5-Thiazolidineacetic acid, 3-(2-(3,4-dimethoxyphenyl)ethyl)-2-((4-methoxyphenyl)imino)-4-oxo-, 2-[3-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-methoxyphenyl)imino-4-oxo-1,3-thiazolidin-5-yl]acetic acid
| Molecular Formula | C22H24N2O6S |
|---|---|
| Molecular Weight | 444.14 g/mol |
| LogP | 3.3613 |
| Topological Polar Surface Area | 97.66 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 444.1355 |
| Heavy Atoms | 31 |
| Complexity | 976.46643 |
Chemical Identifiers
| CAS Number | 67931-69-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N=C2N(C(=O)C(S2)CC(=O)O)CCC3=CC(=C(C=C3)OC)OC |
Product Overview
3-(2-(3,4-Dimethoxyphenyl)ethyl)-2-((4-methoxyphenyl)imino)-4-oxo-5-thiazolidineacetic acid (CAS 67931-69-5), with molecular formula C22H24N2O6S and molecular weight 444.14 g/mol. IUPAC: 2-[3-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-methoxyphenyl)imino-4-oxo-1,3-thiazolidin-5-yl]acetic acid.
Chemical Property Profile of 3-(2-(3,4-Dimethoxyphenyl)ethyl)-2-((4-methoxyphenyl)imino)-4-oxo-5-thiazolidineacetic acid
Property Insights of 3-(2-(3,4-Dimethoxyphenyl)ethyl)-2-((4-methoxyphenyl)imino)-4-oxo-5-thiazolidineacetic acid
The XLogP value of 3.3613 indicates that 3-(2-(3,4-Dimethoxyphenyl)ethyl)-2-((4-methoxyphenyl)imino)-4-oxo-5-thiazolidineacetic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.66 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2-(3,4-Dimethoxyphenyl)ethyl)-2-((4-methoxyphenyl)imino)-4-oxo-5-thiazolidineacetic acid. Following Lipinski's Rule of Five, 3-(2-(3,4-Dimethoxyphenyl)ethyl)-2-((4-methoxyphenyl)imino)-4-oxo-5-thiazolidineacetic acid has 1 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 3-(2-(3,4-Dimethoxyphenyl)ethyl)-2-((4-methoxyphenyl)imino)-4-oxo-5-thiazolidineacetic acid?
The CAS number of 3-(2-(3,4-Dimethoxyphenyl)ethyl)-2-((4-methoxyphenyl)imino)-4-oxo-5-thiazolidineacetic acid is 67931-69-5.
What is the molecular formula of 3-(2-(3,4-Dimethoxyphenyl)ethyl)-2-((4-methoxyphenyl)imino)-4-oxo-5-thiazolidineacetic acid?
The molecular formula of 3-(2-(3,4-Dimethoxyphenyl)ethyl)-2-((4-methoxyphenyl)imino)-4-oxo-5-thiazolidineacetic acid is C22H24N2O6S.
What is the molecular weight of 3-(2-(3,4-Dimethoxyphenyl)ethyl)-2-((4-methoxyphenyl)imino)-4-oxo-5-thiazolidineacetic acid?
The molecular weight of 3-(2-(3,4-Dimethoxyphenyl)ethyl)-2-((4-methoxyphenyl)imino)-4-oxo-5-thiazolidineacetic acid is 444.14 g/mol.
Where can I buy 3-(2-(3,4-Dimethoxyphenyl)ethyl)-2-((4-methoxyphenyl)imino)-4-oxo-5-thiazolidineacetic acid?
You can request a quote for 3-(2-(3,4-Dimethoxyphenyl)ethyl)-2-((4-methoxyphenyl)imino)-4-oxo-5-thiazolidineacetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-(3,4-Dimethoxyphenyl)ethyl)-2-((4-methoxyphenyl)imino)-4-oxo-5-thiazolidineacetic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-(3,4-Dimethoxyphenyl)ethyl)-2-((4-methoxyphenyl)imino)-4-oxo-5-thiazolidineacetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.