(Z)-methyl 4-(5-(2-ethoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)benzoate
TL;DR: (Z)-methyl 4-(5-(2-ethoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)benzoate (CAS 433308-66-8) is a chemical compound with molecular formula C20H17NO4S2 and molecular weight 399.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[(5Z)-5-[(2-ethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzoate
Also Known As: (Z)-methyl 4-(5-(2-ethoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)benzoate, methyl 4-[(5Z)-5-(2-ethoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzoate, methyl 4-[5-(2-ethoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzoate, methyl 4-[(5Z)-5-[(2-ethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzoate
| Molecular Formula | C20H17NO4S2 |
|---|---|
| Molecular Weight | 399.06 g/mol |
| LogP | 4.2777 |
| Topological Polar Surface Area | 55.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 399.0599 |
| Heavy Atoms | 27 |
| Complexity | 921.83386 |
Chemical Identifiers
| CAS Number | 433308-66-8 |
|---|---|
| SMILES | CCOC1=CC=CC=C1/C=C\2/C(=O)N(C(=S)S2)C3=CC=C(C=C3)C(=O)OC |
Product Overview
(Z)-methyl 4-(5-(2-ethoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)benzoate (CAS 433308-66-8), with molecular formula C20H17NO4S2 and molecular weight 399.06 g/mol. IUPAC: methyl 4-[(5Z)-5-[(2-ethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzoate.
Chemical Property Profile of (Z)-methyl 4-(5-(2-ethoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)benzoate
Property Insights of (Z)-methyl 4-(5-(2-ethoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)benzoate
The XLogP value of 4.2777 indicates that (Z)-methyl 4-(5-(2-ethoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.84 Ų, (Z)-methyl 4-(5-(2-ethoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (Z)-methyl 4-(5-(2-ethoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)benzoate has 0 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)-methyl 4-(5-(2-ethoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)benzoate?
The CAS number of (Z)-methyl 4-(5-(2-ethoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)benzoate is 433308-66-8.
What is the molecular formula of (Z)-methyl 4-(5-(2-ethoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)benzoate?
The molecular formula of (Z)-methyl 4-(5-(2-ethoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)benzoate is C20H17NO4S2.
What is the molecular weight of (Z)-methyl 4-(5-(2-ethoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)benzoate?
The molecular weight of (Z)-methyl 4-(5-(2-ethoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)benzoate is 399.06 g/mol.
Where can I buy (Z)-methyl 4-(5-(2-ethoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)benzoate?
You can request a quote for (Z)-methyl 4-(5-(2-ethoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-methyl 4-(5-(2-ethoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)benzoate?
Yes, KEHONG BIO provides custom synthesis services for (Z)-methyl 4-(5-(2-ethoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.