5-(4-Ethoxy-3-methoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one
TL;DR: 5-(4-Ethoxy-3-methoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one (CAS 97852-85-2) is a chemical compound with molecular formula C13H13NO3S2 and molecular weight 295.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[(4-ethoxy-3-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: BAS 00436688, 5-(4-ethoxy-3-methoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one, (5Z)-5-[(4-ETHOXY-3-METHOXYPHENYL)METHYLIDENE]-2-SULFANYLIDENE-1,3-THIAZOLIDIN-4-ONE, (Z)-5-(4-ethoxy-3-methoxybenzylidene)-2-thioxothiazolidin-4-one, 5-(4-Ethoxy-3-methoxy-benzylidene)-2-thioxo-thiazolidin-4-one
| Molecular Formula | C13H13NO3S2 |
|---|---|
| Molecular Weight | 295.03 g/mol |
| LogP | 2.5827 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 295.0337 |
| Heavy Atoms | 19 |
| Complexity | 554.81934 |
Chemical Identifiers
| CAS Number | 97852-85-2 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)/C=C\2/C(=O)NC(=S)S2)OC |
Product Overview
5-(4-Ethoxy-3-methoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one (CAS 97852-85-2), with molecular formula C13H13NO3S2 and molecular weight 295.03 g/mol. IUPAC: (5Z)-5-[(4-ethoxy-3-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of 5-(4-Ethoxy-3-methoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one
Property Insights of 5-(4-Ethoxy-3-methoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one
The XLogP value of 2.5827 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(4-Ethoxy-3-methoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one. With a topological polar surface area (TPSA) of 47.56 Ų, 5-(4-Ethoxy-3-methoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(4-Ethoxy-3-methoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one 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 5-(4-Ethoxy-3-methoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one?
The CAS number of 5-(4-Ethoxy-3-methoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one is 97852-85-2.
What is the molecular formula of 5-(4-Ethoxy-3-methoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one?
The molecular formula of 5-(4-Ethoxy-3-methoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one is C13H13NO3S2.
What is the molecular weight of 5-(4-Ethoxy-3-methoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one?
The molecular weight of 5-(4-Ethoxy-3-methoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one is 295.03 g/mol.
Where can I buy 5-(4-Ethoxy-3-methoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one?
You can request a quote for 5-(4-Ethoxy-3-methoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(4-Ethoxy-3-methoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 5-(4-Ethoxy-3-methoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.