![5-[(2-Carboxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidinepropanoic acid structure](/static/products/2999/299950-18-8.webp)
5-[(2-Carboxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidinepropanoic acid
TL;DR: 5-[(2-Carboxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidinepropanoic acid (CAS 299950-18-8) is a chemical compound with molecular formula C14H11NO5S2 and molecular weight 337.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-(2-carboxyethyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoic acid
Also Known As: 5-[(2-Carboxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidinepropanoic acid, 2-[[3-(2-carboxyethyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoic Acid, 2-{[3-(2-Carboxyethyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}benzoic acid
| Molecular Formula | C14H11NO5S2 |
|---|---|
| Molecular Weight | 337.01 g/mol |
| LogP | 2.0607 |
| Topological Polar Surface Area | 94.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 337.00787 |
| Heavy Atoms | 22 |
| Complexity | 698.2285 |
Chemical Identifiers
| CAS Number | 299950-18-8 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C=C2C(=O)N(C(=S)S2)CCC(=O)O)C(=O)O |
Product Overview
5-[(2-Carboxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidinepropanoic acid (CAS 299950-18-8), with molecular formula C14H11NO5S2 and molecular weight 337.01 g/mol. IUPAC: 2-[[3-(2-carboxyethyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoic acid.
Chemical Property Profile of 5-[(2-Carboxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidinepropanoic acid
Property Insights of 5-[(2-Carboxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidinepropanoic acid
The XLogP value of 2.0607 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[(2-Carboxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidinepropanoic acid. The TPSA of 94.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[(2-Carboxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidinepropanoic acid. Following Lipinski's Rule of Five, 5-[(2-Carboxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidinepropanoic acid has 2 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-[(2-Carboxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidinepropanoic acid?
The CAS number of 5-[(2-Carboxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidinepropanoic acid is 299950-18-8.
What is the molecular formula of 5-[(2-Carboxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidinepropanoic acid?
The molecular formula of 5-[(2-Carboxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidinepropanoic acid is C14H11NO5S2.
What is the molecular weight of 5-[(2-Carboxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidinepropanoic acid?
The molecular weight of 5-[(2-Carboxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidinepropanoic acid is 337.01 g/mol.
Where can I buy 5-[(2-Carboxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidinepropanoic acid?
You can request a quote for 5-[(2-Carboxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidinepropanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[(2-Carboxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidinepropanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-[(2-Carboxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidinepropanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.