2-(4-Oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)propanoic acid
TL;DR: 2-(4-Oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)propanoic acid (CAS 47642-02-4) 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.
2-(4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)propanoic acid
Also Known As: N-Carboxyethylrhodanine, 2-(4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)propanoic acid, Rodanin-3-alpha-propionic acid, 3-(1-carboxyethyl)thiazolidine-4-one-2-thione, 3-alpha-carboxy ethyl rhodanine
| Molecular Formula | C6H7NO3S2 |
|---|---|
| Molecular Weight | 204.99 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 115.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 204.98674 |
| Heavy Atoms | 12 |
| Complexity | 253.0 |
Chemical Identifiers
| CAS Number | 47642-02-4 |
|---|---|
| SMILES | CC(C(=O)O)N1C(=O)CSC1=S |
| InChIKey | STSZELICBFRQES-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(4-Oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)propanoic acid (CAS 47642-02-4), with molecular formula C6H7NO3S2 and molecular weight 204.99 g/mol. IUPAC: 2-(4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)propanoic acid.
Chemical Property Profile of 2-(4-Oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)propanoic acid
Property Insights of 2-(4-Oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)propanoic acid
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)propanoic acid. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)propanoic acid. Following Lipinski's Rule of Five, 2-(4-Oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)propanoic acid 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 2-(4-Oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)propanoic acid?
The CAS number of 2-(4-Oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)propanoic acid is 47642-02-4.
What is the molecular formula of 2-(4-Oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)propanoic acid?
The molecular formula of 2-(4-Oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)propanoic acid is C6H7NO3S2.
What is the molecular weight of 2-(4-Oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)propanoic acid?
The molecular weight of 2-(4-Oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)propanoic acid is 204.99 g/mol.
Where can I buy 2-(4-Oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)propanoic acid?
You can request a quote for 2-(4-Oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)propanoic 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-sulfanylidene-1,3-thiazolidin-3-yl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.