3-Thiazolidinecarboxylic acid, 4-oxo-2-thioxo-, ethyl ester
TL;DR: 3-Thiazolidinecarboxylic acid, 4-oxo-2-thioxo-, ethyl ester (CAS 67952-24-3) is a chemical compound with molecular formula C6H7NO3S2 and molecular weight 204.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-oxo-2-sulfanylidene-1,3-thiazolidine-3-carboxylate
Also Known As: N-Ethoxycarbonylrhodanine, 3-Thiazolidinecarboxylic acid, 4-oxo-2-thioxo-, ethyl ester, Ethyl 4-oxo-2-thioxothiazolidine-4-carboxylate, ethyl 4-oxo-2-sulfanylidene-1,3-thiazolidine-3-carboxylate, 4-Oxo-2-thioxo-3-thiazolidinecarboxylic acid ethyl ester
| Molecular Formula | C6H7NO3S2 |
|---|---|
| Molecular Weight | 204.99 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 204.98674 |
| Heavy Atoms | 12 |
| Complexity | 241.0 |
Chemical Identifiers
| CAS Number | 67952-24-3 |
|---|---|
| SMILES | CCOC(=O)N1C(=O)CSC1=S |
| InChIKey | HRXZNUFSACENKF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Thiazolidinecarboxylic acid, 4-oxo-2-thioxo-, ethyl ester (CAS 67952-24-3), with molecular formula C6H7NO3S2 and molecular weight 204.99 g/mol. IUPAC: ethyl 4-oxo-2-sulfanylidene-1,3-thiazolidine-3-carboxylate.
Chemical Property Profile of 3-Thiazolidinecarboxylic acid, 4-oxo-2-thioxo-, ethyl ester
Property Insights of 3-Thiazolidinecarboxylic acid, 4-oxo-2-thioxo-, ethyl ester
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Thiazolidinecarboxylic acid, 4-oxo-2-thioxo-, ethyl ester. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Thiazolidinecarboxylic acid, 4-oxo-2-thioxo-, ethyl ester. Following Lipinski's Rule of Five, 3-Thiazolidinecarboxylic acid, 4-oxo-2-thioxo-, ethyl ester has 0 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 3-Thiazolidinecarboxylic acid, 4-oxo-2-thioxo-, ethyl ester?
The CAS number of 3-Thiazolidinecarboxylic acid, 4-oxo-2-thioxo-, ethyl ester is 67952-24-3.
What is the molecular formula of 3-Thiazolidinecarboxylic acid, 4-oxo-2-thioxo-, ethyl ester?
The molecular formula of 3-Thiazolidinecarboxylic acid, 4-oxo-2-thioxo-, ethyl ester is C6H7NO3S2.
What is the molecular weight of 3-Thiazolidinecarboxylic acid, 4-oxo-2-thioxo-, ethyl ester?
The molecular weight of 3-Thiazolidinecarboxylic acid, 4-oxo-2-thioxo-, ethyl ester is 204.99 g/mol.
Where can I buy 3-Thiazolidinecarboxylic acid, 4-oxo-2-thioxo-, ethyl ester?
You can request a quote for 3-Thiazolidinecarboxylic acid, 4-oxo-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 3-Thiazolidinecarboxylic acid, 4-oxo-2-thioxo-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 3-Thiazolidinecarboxylic acid, 4-oxo-2-thioxo-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.