2-(4-Oxo-2-thioxo-1,3-thiazolidin-3-yl)ethanesulfonic acid
TL;DR: 2-(4-Oxo-2-thioxo-1,3-thiazolidin-3-yl)ethanesulfonic acid (CAS 75504-95-9) is a chemical compound with molecular formula C5H7NO4S3 and molecular weight 240.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)ethanesulfonic acid
Also Known As: rhodanine-3-ethane sulfonic acid, BAS 01151197, 2-(4-oxo-2-thioxo-1,3-thiazolidin-3-yl)ethanesulfonic acid, 3-Thiazolidineethanesulfonic acid, 4-oxo-2-thioxo-, 2-(4-Oxo-2-thioxo-thiazolidin-3-yl)-ethanesulfonic acid
| Molecular Formula | C5H7NO4S3 |
|---|---|
| Molecular Weight | 240.95 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 140.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 240.95372 |
| Heavy Atoms | 13 |
| Complexity | 330.0 |
Chemical Identifiers
| CAS Number | 75504-95-9 |
|---|---|
| SMILES | C1C(=O)N(C(=S)S1)CCS(=O)(=O)O |
| InChIKey | DSUXCYDUDCRSDA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(4-Oxo-2-thioxo-1,3-thiazolidin-3-yl)ethanesulfonic acid (CAS 75504-95-9), with molecular formula C5H7NO4S3 and molecular weight 240.95 g/mol. IUPAC: 2-(4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)ethanesulfonic acid.
Chemical Property Profile of 2-(4-Oxo-2-thioxo-1,3-thiazolidin-3-yl)ethanesulfonic acid
Property Insights of 2-(4-Oxo-2-thioxo-1,3-thiazolidin-3-yl)ethanesulfonic acid
The XLogP value of -0.3 indicates that 2-(4-Oxo-2-thioxo-1,3-thiazolidin-3-yl)ethanesulfonic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 140.0 Ų indicates high polarity, suggesting 2-(4-Oxo-2-thioxo-1,3-thiazolidin-3-yl)ethanesulfonic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-(4-Oxo-2-thioxo-1,3-thiazolidin-3-yl)ethanesulfonic 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 2-(4-Oxo-2-thioxo-1,3-thiazolidin-3-yl)ethanesulfonic acid?
The CAS number of 2-(4-Oxo-2-thioxo-1,3-thiazolidin-3-yl)ethanesulfonic acid is 75504-95-9.
What is the molecular formula of 2-(4-Oxo-2-thioxo-1,3-thiazolidin-3-yl)ethanesulfonic acid?
The molecular formula of 2-(4-Oxo-2-thioxo-1,3-thiazolidin-3-yl)ethanesulfonic acid is C5H7NO4S3.
What is the molecular weight of 2-(4-Oxo-2-thioxo-1,3-thiazolidin-3-yl)ethanesulfonic acid?
The molecular weight of 2-(4-Oxo-2-thioxo-1,3-thiazolidin-3-yl)ethanesulfonic acid is 240.95 g/mol.
Where can I buy 2-(4-Oxo-2-thioxo-1,3-thiazolidin-3-yl)ethanesulfonic acid?
You can request a quote for 2-(4-Oxo-2-thioxo-1,3-thiazolidin-3-yl)ethanesulfonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Oxo-2-thioxo-1,3-thiazolidin-3-yl)ethanesulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Oxo-2-thioxo-1,3-thiazolidin-3-yl)ethanesulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.