![Ethyl 2-[3-[(5-acetyl-2-ethoxyphenyl)methyl]-4-oxo-2-thiazolidinylidene]acetate structure](/static/products/869/869472-70-8.png)
Ethyl 2-[3-[(5-acetyl-2-ethoxyphenyl)methyl]-4-oxo-2-thiazolidinylidene]acetate
TL;DR: Ethyl 2-[3-[(5-acetyl-2-ethoxyphenyl)methyl]-4-oxo-2-thiazolidinylidene]acetate (CAS 869472-70-8) is a chemical compound with molecular formula C18H21NO5S and molecular weight 363.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[3-[(5-acetyl-2-ethoxyphenyl)methyl]-4-oxo-1,3-thiazolidin-2-ylidene]acetate
Also Known As: Ethyl 2-[3-[(5-acetyl-2-ethoxyphenyl)methyl]-4-oxo-2-thiazolidinylidene]acetate, ethyl (2E)-[3-(5-acetyl-2-ethoxybenzyl)-4-oxo-1,3-thiazolidin-2-ylidene]acetate, Ethyl (z)-2-(3-(5-acetyl-2-ethoxybenzyl)-4-oxothiazolidin-2-ylidene)acetate, Ethyl {3-[(5-acetyl-2-ethoxyphenyl)methyl]-4-oxo-1,3-thiazolidin-2-ylidene}acetate, ethyl 2-[3-[(5-acetyl-2-ethoxy-phenyl)methyl]-4-oxo-thiazolidin-2-ylidene]acetate
| Molecular Formula | C18H21NO5S |
|---|---|
| Molecular Weight | 363.11 g/mol |
| LogP | 2.7678 |
| Topological Polar Surface Area | 72.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 363.11404 |
| Heavy Atoms | 25 |
| Complexity | 713.418 |
Chemical Identifiers
| CAS Number | 869472-70-8 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)C(=O)C)CN2C(=O)CSC2=CC(=O)OCC |
Product Overview
Ethyl 2-[3-[(5-acetyl-2-ethoxyphenyl)methyl]-4-oxo-2-thiazolidinylidene]acetate (CAS 869472-70-8), with molecular formula C18H21NO5S and molecular weight 363.11 g/mol. IUPAC: ethyl 2-[3-[(5-acetyl-2-ethoxyphenyl)methyl]-4-oxo-1,3-thiazolidin-2-ylidene]acetate.
Chemical Property Profile of Ethyl 2-[3-[(5-acetyl-2-ethoxyphenyl)methyl]-4-oxo-2-thiazolidinylidene]acetate
Property Insights of Ethyl 2-[3-[(5-acetyl-2-ethoxyphenyl)methyl]-4-oxo-2-thiazolidinylidene]acetate
The XLogP value of 2.7678 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-[3-[(5-acetyl-2-ethoxyphenyl)methyl]-4-oxo-2-thiazolidinylidene]acetate. The TPSA of 72.91 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-[3-[(5-acetyl-2-ethoxyphenyl)methyl]-4-oxo-2-thiazolidinylidene]acetate. Following Lipinski's Rule of Five, Ethyl 2-[3-[(5-acetyl-2-ethoxyphenyl)methyl]-4-oxo-2-thiazolidinylidene]acetate has 0 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 Ethyl 2-[3-[(5-acetyl-2-ethoxyphenyl)methyl]-4-oxo-2-thiazolidinylidene]acetate?
The CAS number of Ethyl 2-[3-[(5-acetyl-2-ethoxyphenyl)methyl]-4-oxo-2-thiazolidinylidene]acetate is 869472-70-8.
What is the molecular formula of Ethyl 2-[3-[(5-acetyl-2-ethoxyphenyl)methyl]-4-oxo-2-thiazolidinylidene]acetate?
The molecular formula of Ethyl 2-[3-[(5-acetyl-2-ethoxyphenyl)methyl]-4-oxo-2-thiazolidinylidene]acetate is C18H21NO5S.
What is the molecular weight of Ethyl 2-[3-[(5-acetyl-2-ethoxyphenyl)methyl]-4-oxo-2-thiazolidinylidene]acetate?
The molecular weight of Ethyl 2-[3-[(5-acetyl-2-ethoxyphenyl)methyl]-4-oxo-2-thiazolidinylidene]acetate is 363.11 g/mol.
Where can I buy Ethyl 2-[3-[(5-acetyl-2-ethoxyphenyl)methyl]-4-oxo-2-thiazolidinylidene]acetate?
You can request a quote for Ethyl 2-[3-[(5-acetyl-2-ethoxyphenyl)methyl]-4-oxo-2-thiazolidinylidene]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-[3-[(5-acetyl-2-ethoxyphenyl)methyl]-4-oxo-2-thiazolidinylidene]acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-[3-[(5-acetyl-2-ethoxyphenyl)methyl]-4-oxo-2-thiazolidinylidene]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.