3-(4-Ethoxy-phenyl)-5-(4-nitro-benzylidene)-2-thioxo-thiazolidin-4-one
TL;DR: 3-(4-Ethoxy-phenyl)-5-(4-nitro-benzylidene)-2-thioxo-thiazolidin-4-one (CAS 303028-82-2) is a chemical compound with molecular formula C18H14N2O4S2 and molecular weight 386.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-3-(4-ethoxyphenyl)-5-[(4-nitrophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: BAS 00564824, AB00080802-01, 3-(4-Ethoxy-phenyl)-5-(4-nitro-benzylidene)-2-thioxo-thiazolidin-4-one, (5Z)-3-(4-ethoxyphenyl)-5-[(4-nitrophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one, (Z)-3-(4-ethoxyphenyl)-5-(4-nitrobenzylidene)-2-thioxothiazolidin-4-one
| Molecular Formula | C18H14N2O4S2 |
|---|---|
| Molecular Weight | 386.04 g/mol |
| LogP | 4.3993 |
| Topological Polar Surface Area | 72.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 386.0395 |
| Heavy Atoms | 26 |
| Complexity | 892.41205 |
Chemical Identifiers
| CAS Number | 303028-82-2 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2C(=O)/C(=C/C3=CC=C(C=C3)[N+](=O)[O-])/SC2=S |
Product Overview
3-(4-Ethoxy-phenyl)-5-(4-nitro-benzylidene)-2-thioxo-thiazolidin-4-one (CAS 303028-82-2), with molecular formula C18H14N2O4S2 and molecular weight 386.04 g/mol. IUPAC: (5Z)-3-(4-ethoxyphenyl)-5-[(4-nitrophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of 3-(4-Ethoxy-phenyl)-5-(4-nitro-benzylidene)-2-thioxo-thiazolidin-4-one
Property Insights of 3-(4-Ethoxy-phenyl)-5-(4-nitro-benzylidene)-2-thioxo-thiazolidin-4-one
The XLogP value of 4.3993 indicates that 3-(4-Ethoxy-phenyl)-5-(4-nitro-benzylidene)-2-thioxo-thiazolidin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-Ethoxy-phenyl)-5-(4-nitro-benzylidene)-2-thioxo-thiazolidin-4-one. Following Lipinski's Rule of Five, 3-(4-Ethoxy-phenyl)-5-(4-nitro-benzylidene)-2-thioxo-thiazolidin-4-one 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 3-(4-Ethoxy-phenyl)-5-(4-nitro-benzylidene)-2-thioxo-thiazolidin-4-one?
The CAS number of 3-(4-Ethoxy-phenyl)-5-(4-nitro-benzylidene)-2-thioxo-thiazolidin-4-one is 303028-82-2.
What is the molecular formula of 3-(4-Ethoxy-phenyl)-5-(4-nitro-benzylidene)-2-thioxo-thiazolidin-4-one?
The molecular formula of 3-(4-Ethoxy-phenyl)-5-(4-nitro-benzylidene)-2-thioxo-thiazolidin-4-one is C18H14N2O4S2.
What is the molecular weight of 3-(4-Ethoxy-phenyl)-5-(4-nitro-benzylidene)-2-thioxo-thiazolidin-4-one?
The molecular weight of 3-(4-Ethoxy-phenyl)-5-(4-nitro-benzylidene)-2-thioxo-thiazolidin-4-one is 386.04 g/mol.
Where can I buy 3-(4-Ethoxy-phenyl)-5-(4-nitro-benzylidene)-2-thioxo-thiazolidin-4-one?
You can request a quote for 3-(4-Ethoxy-phenyl)-5-(4-nitro-benzylidene)-2-thioxo-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 3-(4-Ethoxy-phenyl)-5-(4-nitro-benzylidene)-2-thioxo-thiazolidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Ethoxy-phenyl)-5-(4-nitro-benzylidene)-2-thioxo-thiazolidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.