5-Thiazolidinecarboxylic acid, 3-ethyl-4-hydroxy-4-methyl-2-thioxo-, ethyl ester
TL;DR: 5-Thiazolidinecarboxylic acid, 3-ethyl-4-hydroxy-4-methyl-2-thioxo-, ethyl ester (CAS 26766-37-0) is a chemical compound with molecular formula C9H15NO3S2 and molecular weight 249.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-ethyl-4-hydroxy-4-methyl-2-sulfanylidene-1,3-thiazolidine-5-carboxylate
Also Known As: 3-Ethyl-4-hydroxy-4-methyl-2-thioxo-5-thiazolidinecarboxylic acid ethyl ester, 5-Thiazolidinecarboxylic acid, 3-ethyl-4-hydroxy-4-methyl-2-thioxo-, ethyl ester, ethyl 3-ethyl-4-hydroxy-4-methyl-2-sulfanylidene-1,3-thiazolidine-5-carboxylate, ethyl 3-ethyl-4-hydroxy-4-methyl-2-thioxo-1,3-thiazolidine-5-carboxylate, 5-Thiazolidinecarboxylicacid, 3-ethyl-4-hydroxy-4-methyl-2-thioxo-, ethyl ester
| Molecular Formula | C9H15NO3S2 |
|---|---|
| Molecular Weight | 249.05 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 107.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 249.04933 |
| Heavy Atoms | 15 |
| Complexity | 285.0 |
Chemical Identifiers
| CAS Number | 26766-37-0 |
|---|---|
| SMILES | CCN1C(=S)SC(C1(C)O)C(=O)OCC |
| InChIKey | NNLKEEKTUXDDCX-UHFFFAOYSA-N |
Product Overview
5-Thiazolidinecarboxylic acid, 3-ethyl-4-hydroxy-4-methyl-2-thioxo-, ethyl ester (CAS 26766-37-0), with molecular formula C9H15NO3S2 and molecular weight 249.05 g/mol. IUPAC: ethyl 3-ethyl-4-hydroxy-4-methyl-2-sulfanylidene-1,3-thiazolidine-5-carboxylate.
Chemical Property Profile of 5-Thiazolidinecarboxylic acid, 3-ethyl-4-hydroxy-4-methyl-2-thioxo-, ethyl ester
Property Insights of 5-Thiazolidinecarboxylic acid, 3-ethyl-4-hydroxy-4-methyl-2-thioxo-, ethyl ester
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Thiazolidinecarboxylic acid, 3-ethyl-4-hydroxy-4-methyl-2-thioxo-, ethyl ester. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Thiazolidinecarboxylic acid, 3-ethyl-4-hydroxy-4-methyl-2-thioxo-, ethyl ester. Following Lipinski's Rule of Five, 5-Thiazolidinecarboxylic acid, 3-ethyl-4-hydroxy-4-methyl-2-thioxo-, ethyl ester has 1 hydrogen bond donor(s) and 5 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 5-Thiazolidinecarboxylic acid, 3-ethyl-4-hydroxy-4-methyl-2-thioxo-, ethyl ester?
The CAS number of 5-Thiazolidinecarboxylic acid, 3-ethyl-4-hydroxy-4-methyl-2-thioxo-, ethyl ester is 26766-37-0.
What is the molecular formula of 5-Thiazolidinecarboxylic acid, 3-ethyl-4-hydroxy-4-methyl-2-thioxo-, ethyl ester?
The molecular formula of 5-Thiazolidinecarboxylic acid, 3-ethyl-4-hydroxy-4-methyl-2-thioxo-, ethyl ester is C9H15NO3S2.
What is the molecular weight of 5-Thiazolidinecarboxylic acid, 3-ethyl-4-hydroxy-4-methyl-2-thioxo-, ethyl ester?
The molecular weight of 5-Thiazolidinecarboxylic acid, 3-ethyl-4-hydroxy-4-methyl-2-thioxo-, ethyl ester is 249.05 g/mol.
Where can I buy 5-Thiazolidinecarboxylic acid, 3-ethyl-4-hydroxy-4-methyl-2-thioxo-, ethyl ester?
You can request a quote for 5-Thiazolidinecarboxylic acid, 3-ethyl-4-hydroxy-4-methyl-2-thioxo-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Thiazolidinecarboxylic acid, 3-ethyl-4-hydroxy-4-methyl-2-thioxo-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 5-Thiazolidinecarboxylic acid, 3-ethyl-4-hydroxy-4-methyl-2-thioxo-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.