3-(2,4-Dithioxo-1,3-thiazolidin-3-yl)propanoic acid
TL;DR: 3-(2,4-Dithioxo-1,3-thiazolidin-3-yl)propanoic acid (CAS 60708-94-3) is a chemical compound with molecular formula C6H7NO2S3 and molecular weight 220.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2,4-bis(sulfanylidene)-1,3-thiazolidin-3-yl]propanoic acid
Also Known As: NCIStruc1_000719, NCIStruc2_000707, NCI60_002664, 3-(2,4-dithioxo-1,3-thiazolidin-3-yl)propanoic acid, 3-(2,4-Disulfanylidenethiazolidin-3-yl)propanoic acid
| Molecular Formula | C6H7NO2S3 |
|---|---|
| Molecular Weight | 220.96 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 130.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 220.9639 |
| Heavy Atoms | 12 |
| Complexity | 241.0 |
Chemical Identifiers
| CAS Number | 60708-94-3 |
|---|---|
| SMILES | C1C(=S)N(C(=S)S1)CCC(=O)O |
| InChIKey | ROONOSCQTGQBKL-UHFFFAOYSA-N |
Product Overview
3-(2,4-Dithioxo-1,3-thiazolidin-3-yl)propanoic acid (CAS 60708-94-3), with molecular formula C6H7NO2S3 and molecular weight 220.96 g/mol. IUPAC: 3-[2,4-bis(sulfanylidene)-1,3-thiazolidin-3-yl]propanoic acid.
Chemical Property Profile of 3-(2,4-Dithioxo-1,3-thiazolidin-3-yl)propanoic acid
Property Insights of 3-(2,4-Dithioxo-1,3-thiazolidin-3-yl)propanoic acid
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2,4-Dithioxo-1,3-thiazolidin-3-yl)propanoic acid. The TPSA of 130.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2,4-Dithioxo-1,3-thiazolidin-3-yl)propanoic acid. Following Lipinski's Rule of Five, 3-(2,4-Dithioxo-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 3-(2,4-Dithioxo-1,3-thiazolidin-3-yl)propanoic acid?
The CAS number of 3-(2,4-Dithioxo-1,3-thiazolidin-3-yl)propanoic acid is 60708-94-3.
What is the molecular formula of 3-(2,4-Dithioxo-1,3-thiazolidin-3-yl)propanoic acid?
The molecular formula of 3-(2,4-Dithioxo-1,3-thiazolidin-3-yl)propanoic acid is C6H7NO2S3.
What is the molecular weight of 3-(2,4-Dithioxo-1,3-thiazolidin-3-yl)propanoic acid?
The molecular weight of 3-(2,4-Dithioxo-1,3-thiazolidin-3-yl)propanoic acid is 220.96 g/mol.
Where can I buy 3-(2,4-Dithioxo-1,3-thiazolidin-3-yl)propanoic acid?
You can request a quote for 3-(2,4-Dithioxo-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 3-(2,4-Dithioxo-1,3-thiazolidin-3-yl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(2,4-Dithioxo-1,3-thiazolidin-3-yl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.