(5Z)-3-(3-methoxyphenyl)-5-(4-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one
TL;DR: (5Z)-3-(3-methoxyphenyl)-5-(4-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one (CAS 5555-66-8) is a chemical compound with molecular formula C17H12N2O4S2 and molecular weight 372.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-3-(3-methoxyphenyl)-5-[(4-nitrophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: AB00088926-01, 3-(3-methoxyphenyl)-5-(4-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one, (5Z)-3-(3-methoxyphenyl)-5-(4-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one, 3-(3-methoxyphenyl)-5-[(4-nitrophenyl)methylene]-2-thioxo-1,3-thiazolidin-4-on e, (5Z)-3-(3-methoxyphenyl)-5-[(4-nitrophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
| Molecular Formula | C17H12N2O4S2 |
|---|---|
| Molecular Weight | 372.02 g/mol |
| LogP | 4.0092 |
| Topological Polar Surface Area | 72.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 372.02383 |
| Heavy Atoms | 25 |
| Complexity | 893.7758 |
Chemical Identifiers
| CAS Number | 5555-66-8 |
|---|---|
| SMILES | COC1=CC=CC(=C1)N2C(=O)/C(=C/C3=CC=C(C=C3)[N+](=O)[O-])/SC2=S |
Product Overview
(5Z)-3-(3-methoxyphenyl)-5-(4-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one (CAS 5555-66-8), with molecular formula C17H12N2O4S2 and molecular weight 372.02 g/mol. IUPAC: (5Z)-3-(3-methoxyphenyl)-5-[(4-nitrophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of (5Z)-3-(3-methoxyphenyl)-5-(4-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one
Property Insights of (5Z)-3-(3-methoxyphenyl)-5-(4-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one
The XLogP value of 4.0092 indicates that (5Z)-3-(3-methoxyphenyl)-5-(4-nitrobenzylidene)-2-thioxo-1,3-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 (5Z)-3-(3-methoxyphenyl)-5-(4-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one. Following Lipinski's Rule of Five, (5Z)-3-(3-methoxyphenyl)-5-(4-nitrobenzylidene)-2-thioxo-1,3-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 (5Z)-3-(3-methoxyphenyl)-5-(4-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one?
The CAS number of (5Z)-3-(3-methoxyphenyl)-5-(4-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one is 5555-66-8.
What is the molecular formula of (5Z)-3-(3-methoxyphenyl)-5-(4-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one?
The molecular formula of (5Z)-3-(3-methoxyphenyl)-5-(4-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one is C17H12N2O4S2.
What is the molecular weight of (5Z)-3-(3-methoxyphenyl)-5-(4-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one?
The molecular weight of (5Z)-3-(3-methoxyphenyl)-5-(4-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one is 372.02 g/mol.
Where can I buy (5Z)-3-(3-methoxyphenyl)-5-(4-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one?
You can request a quote for (5Z)-3-(3-methoxyphenyl)-5-(4-nitrobenzylidene)-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 (5Z)-3-(3-methoxyphenyl)-5-(4-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for (5Z)-3-(3-methoxyphenyl)-5-(4-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.