(Z)-3-(3-(5-(4-chlorobenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-2,5-dioxopyrrolidin-1-yl)propanoic acid
TL;DR: (Z)-3-(3-(5-(4-chlorobenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-2,5-dioxopyrrolidin-1-yl)propanoic acid (CAS 1164115-23-4) is a chemical compound with molecular formula C17H13ClN2O5S2 and molecular weight 424.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3-[(5Z)-5-[(4-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-2,5-dioxopyrrolidin-1-yl]propanoic acid
Also Known As: (Z)-3-(3-(5-(4-chlorobenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-2,5-dioxopyrrolidin-1-yl)propanoic acid, 3-[3-[(5Z)-5-[(4-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-2,5-dioxopyrrolidin-1-yl]propanoic acid, 3-{3-[(5Z)-5-[(4-CHLOROPHENYL)METHYLIDENE]-4-OXO-2-SULFANYLIDENE-1,3-THIAZOLIDIN-3-YL]-2,5-DIOXOPYRROLIDIN-1-YL}PROPANOIC ACID, 3-(3-{5-[(4-chlorophenyl)methylene]-4-oxo-2-thioxo(1,3-thiazolidin-3-yl)}-2,5- dioxoazolidinyl)propanoic acid, 3-[3-[(5Z)-5-(4-chlorobenzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]-2,5-diketo-pyrrolidino]propionic acid
| Molecular Formula | C17H13ClN2O5S2 |
|---|---|
| Molecular Weight | 424.00 g/mol |
| LogP | 2.1434 |
| Topological Polar Surface Area | 94.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 423.99545 |
| Heavy Atoms | 27 |
| Complexity | 883.8149 |
Chemical Identifiers
| CAS Number | 1164115-23-4 |
|---|---|
| SMILES | C1C(C(=O)N(C1=O)CCC(=O)O)N2C(=O)/C(=C/C3=CC=C(C=C3)Cl)/SC2=S |
Product Overview
(Z)-3-(3-(5-(4-chlorobenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-2,5-dioxopyrrolidin-1-yl)propanoic acid (CAS 1164115-23-4), with molecular formula C17H13ClN2O5S2 and molecular weight 424.00 g/mol. IUPAC: 3-[3-[(5Z)-5-[(4-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-2,5-dioxopyrrolidin-1-yl]propanoic acid.
Chemical Property Profile of (Z)-3-(3-(5-(4-chlorobenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-2,5-dioxopyrrolidin-1-yl)propanoic acid
Property Insights of (Z)-3-(3-(5-(4-chlorobenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-2,5-dioxopyrrolidin-1-yl)propanoic acid
The XLogP value of 2.1434 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-3-(3-(5-(4-chlorobenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-2,5-dioxopyrrolidin-1-yl)propanoic acid. The TPSA of 94.99 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-3-(3-(5-(4-chlorobenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-2,5-dioxopyrrolidin-1-yl)propanoic acid. Following Lipinski's Rule of Five, (Z)-3-(3-(5-(4-chlorobenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-2,5-dioxopyrrolidin-1-yl)propanoic acid has 1 hydrogen bond donor(s) and 6 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 (Z)-3-(3-(5-(4-chlorobenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-2,5-dioxopyrrolidin-1-yl)propanoic acid?
The CAS number of (Z)-3-(3-(5-(4-chlorobenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-2,5-dioxopyrrolidin-1-yl)propanoic acid is 1164115-23-4.
What is the molecular formula of (Z)-3-(3-(5-(4-chlorobenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-2,5-dioxopyrrolidin-1-yl)propanoic acid?
The molecular formula of (Z)-3-(3-(5-(4-chlorobenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-2,5-dioxopyrrolidin-1-yl)propanoic acid is C17H13ClN2O5S2.
What is the molecular weight of (Z)-3-(3-(5-(4-chlorobenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-2,5-dioxopyrrolidin-1-yl)propanoic acid?
The molecular weight of (Z)-3-(3-(5-(4-chlorobenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-2,5-dioxopyrrolidin-1-yl)propanoic acid is 424.00 g/mol.
Where can I buy (Z)-3-(3-(5-(4-chlorobenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-2,5-dioxopyrrolidin-1-yl)propanoic acid?
You can request a quote for (Z)-3-(3-(5-(4-chlorobenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-2,5-dioxopyrrolidin-1-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 (Z)-3-(3-(5-(4-chlorobenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-2,5-dioxopyrrolidin-1-yl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (Z)-3-(3-(5-(4-chlorobenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-2,5-dioxopyrrolidin-1-yl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.