(5-(4-Ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-YL)acetic acid
TL;DR: (5-(4-Ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-YL)acetic acid (CAS 124347-15-5) is a chemical compound with molecular formula C14H13NO3S2 and molecular weight 307.0337 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(5E)-5-[(4-ethylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid
Also Known As: BIM-0031368.P001, (E)-2-(5-(4-ethylbenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)acetic acid, (5-(4-ETHYLBENZYLIDENE)-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-3-YL)ACETIC ACID, [(5E)-5-(4-ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid, 2-[(5E)-5-[(4-ethylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid
Technical Specifications
| Molecular Formula | C14H13NO3S2 |
| Molecular Weight | 307.0337 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 115.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 307.0337 Da |
| Heavy Atoms | 20 |
| Complexity | 453.0 |
| SMILES | CCC1=CC=C(C=C1)/C=C/2\C(=O)N(C(=S)S2)CC(=O)O |
| InChIKey | WTKFPFYSVPORPN-YRNVUSSQSA-N |
Chemical Property Profile of (5-(4-Ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-YL)acetic acid
Property Insights of (5-(4-Ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-YL)acetic acid
The XLogP value of 3.4 indicates that (5-(4-Ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-YL)acetic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (5-(4-Ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-YL)acetic acid. Following Lipinski's Rule of Five, (5-(4-Ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-YL)acetic 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
What is the CAS number of (5-(4-Ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-YL)acetic acid?
The CAS number of (5-(4-Ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-YL)acetic acid is 124347-15-5.
What is the molecular formula of (5-(4-Ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-YL)acetic acid?
The molecular formula of (5-(4-Ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-YL)acetic acid is C14H13NO3S2.
What is the molecular weight of (5-(4-Ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-YL)acetic acid?
The molecular weight of (5-(4-Ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-YL)acetic acid is 307.0337 g/mol.
Where can I buy (5-(4-Ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-YL)acetic acid?
You can request a quote for (5-(4-Ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-YL)acetic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (5-(4-Ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-YL)acetic acid?
Yes, CoreyChem provides custom synthesis services for (5-(4-Ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-YL)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.