(E)-6-(5-(4-(diethylamino)benzylidene)-4-oxo-2-thioxothiazolidin-3-yl)hexanoic acid
TL;DR: (E)-6-(5-(4-(diethylamino)benzylidene)-4-oxo-2-thioxothiazolidin-3-yl)hexanoic acid (CAS 15055-69-3) is a chemical compound with molecular formula C20H26N2O3S2 and molecular weight 406.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(5E)-5-[[4-(diethylamino)phenyl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid
Also Known As: (E)-6-(5-(4-(diethylamino)benzylidene)-4-oxo-2-thioxothiazolidin-3-yl)hexanoic acid, 6-[(5E)-5-[[4-(diethylamino)phenyl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid, 6-[(5E)-5-{[4-(DIETHYLAMINO)PHENYL]METHYLIDENE}-4-OXO-2-SULFANYLIDENE-1,3-THIAZOLIDIN-3-YL]HEXANOIC ACID, 6-[5-[(4-diethylaminophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic Acid
| Molecular Formula | C20H26N2O3S2 |
|---|---|
| Molecular Weight | 406.14 g/mol |
| LogP | 4.379 |
| Topological Polar Surface Area | 60.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 406.1385 |
| Heavy Atoms | 27 |
| Complexity | 712.44196 |
Chemical Identifiers
| CAS Number | 15055-69-3 |
|---|---|
| SMILES | CCN(CC)C1=CC=C(C=C1)/C=C/2\C(=O)N(C(=S)S2)CCCCCC(=O)O |
Product Overview
(E)-6-(5-(4-(diethylamino)benzylidene)-4-oxo-2-thioxothiazolidin-3-yl)hexanoic acid (CAS 15055-69-3), with molecular formula C20H26N2O3S2 and molecular weight 406.14 g/mol. IUPAC: 6-[(5E)-5-[[4-(diethylamino)phenyl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid.
Chemical Property Profile of (E)-6-(5-(4-(diethylamino)benzylidene)-4-oxo-2-thioxothiazolidin-3-yl)hexanoic acid
Property Insights of (E)-6-(5-(4-(diethylamino)benzylidene)-4-oxo-2-thioxothiazolidin-3-yl)hexanoic acid
The XLogP value of 4.379 indicates that (E)-6-(5-(4-(diethylamino)benzylidene)-4-oxo-2-thioxothiazolidin-3-yl)hexanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.85 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-6-(5-(4-(diethylamino)benzylidene)-4-oxo-2-thioxothiazolidin-3-yl)hexanoic acid. Following Lipinski's Rule of Five, (E)-6-(5-(4-(diethylamino)benzylidene)-4-oxo-2-thioxothiazolidin-3-yl)hexanoic 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 (E)-6-(5-(4-(diethylamino)benzylidene)-4-oxo-2-thioxothiazolidin-3-yl)hexanoic acid?
The CAS number of (E)-6-(5-(4-(diethylamino)benzylidene)-4-oxo-2-thioxothiazolidin-3-yl)hexanoic acid is 15055-69-3.
What is the molecular formula of (E)-6-(5-(4-(diethylamino)benzylidene)-4-oxo-2-thioxothiazolidin-3-yl)hexanoic acid?
The molecular formula of (E)-6-(5-(4-(diethylamino)benzylidene)-4-oxo-2-thioxothiazolidin-3-yl)hexanoic acid is C20H26N2O3S2.
What is the molecular weight of (E)-6-(5-(4-(diethylamino)benzylidene)-4-oxo-2-thioxothiazolidin-3-yl)hexanoic acid?
The molecular weight of (E)-6-(5-(4-(diethylamino)benzylidene)-4-oxo-2-thioxothiazolidin-3-yl)hexanoic acid is 406.14 g/mol.
Where can I buy (E)-6-(5-(4-(diethylamino)benzylidene)-4-oxo-2-thioxothiazolidin-3-yl)hexanoic acid?
You can request a quote for (E)-6-(5-(4-(diethylamino)benzylidene)-4-oxo-2-thioxothiazolidin-3-yl)hexanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-6-(5-(4-(diethylamino)benzylidene)-4-oxo-2-thioxothiazolidin-3-yl)hexanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (E)-6-(5-(4-(diethylamino)benzylidene)-4-oxo-2-thioxothiazolidin-3-yl)hexanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.