3-(5-(2-Methoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)propanoic acid
TL;DR: 3-(5-(2-Methoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)propanoic acid (CAS 302824-30-2) is a chemical compound with molecular formula C14H13NO4S2 and molecular weight 323.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[5-[(2-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid
Also Known As: BAS 00776687, 3-(5-(2-Methoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)propanoic acid, 3-[5-(2-Methoxy-benzylidene)-4-oxo-2-thioxo-thiazolidin-3-yl]-propionic acid, 3-[5-[(2-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid
| Molecular Formula | C14H13NO4S2 |
|---|---|
| Molecular Weight | 323.03 g/mol |
| LogP | 2.3711 |
| Topological Polar Surface Area | 66.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 323.0286 |
| Heavy Atoms | 21 |
| Complexity | 627.15497 |
Chemical Identifiers
| CAS Number | 302824-30-2 |
|---|---|
| SMILES | COC1=CC=CC=C1C=C2C(=O)N(C(=S)S2)CCC(=O)O |
Product Overview
3-(5-(2-Methoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)propanoic acid (CAS 302824-30-2), with molecular formula C14H13NO4S2 and molecular weight 323.03 g/mol. IUPAC: 3-[5-[(2-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid.
Chemical Property Profile of 3-(5-(2-Methoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)propanoic acid
Property Insights of 3-(5-(2-Methoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)propanoic acid
The XLogP value of 2.3711 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(5-(2-Methoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)propanoic acid. The TPSA of 66.84 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(5-(2-Methoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)propanoic acid. Following Lipinski's Rule of Five, 3-(5-(2-Methoxybenzylidene)-4-oxo-2-thioxothiazolidin-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-(5-(2-Methoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)propanoic acid?
The CAS number of 3-(5-(2-Methoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)propanoic acid is 302824-30-2.
What is the molecular formula of 3-(5-(2-Methoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)propanoic acid?
The molecular formula of 3-(5-(2-Methoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)propanoic acid is C14H13NO4S2.
What is the molecular weight of 3-(5-(2-Methoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)propanoic acid?
The molecular weight of 3-(5-(2-Methoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)propanoic acid is 323.03 g/mol.
Where can I buy 3-(5-(2-Methoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)propanoic acid?
You can request a quote for 3-(5-(2-Methoxybenzylidene)-4-oxo-2-thioxothiazolidin-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-(5-(2-Methoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(5-(2-Methoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.