(5E)-5-(4-hydroxy-3-nitrobenzylidene)-3-(3-methylphenyl)-2-thioxo-1,3-thiazolidin-4-one
TL;DR: (5E)-5-(4-hydroxy-3-nitrobenzylidene)-3-(3-methylphenyl)-2-thioxo-1,3-thiazolidin-4-one (CAS 306279-79-8) 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.
(5E)-5-[(4-hydroxy-3-nitrophenyl)methylidene]-3-(3-methylphenyl)-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: (5E)-5-(4-hydroxy-3-nitrobenzylidene)-3-(3-methylphenyl)-2-thioxo-1,3-thiazolidin-4-one, (5E)-5-[(4-hydroxy-3-nitrophenyl)methylidene]-3-(3-methylphenyl)-2-sulfanylidene-1,3-thiazolidin-4-one, (E)-5-(4-hydroxy-3-nitrobenzylidene)-2-thioxo-3-(m-tolyl)thiazolidin-4-one, 5-[(4-hydroxy-3-nitrophenyl)methylene]-3-(3-methylphenyl)-2-thioxo-1,3-thiazol idin-4-one, 5-[(4-hydroxy-3-nitro-phenyl)methylidene]-3-(3-methylphenyl)-2-sulfanylidene-1,3-thiazolidin-4-one
| Molecular Formula | C17H12N2O4S2 |
|---|---|
| Molecular Weight | 372.02 g/mol |
| LogP | 4.01462 |
| Topological Polar Surface Area | 83.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 372.02383 |
| Heavy Atoms | 25 |
| Complexity | 939.9951 |
Chemical Identifiers
| CAS Number | 306279-79-8 |
|---|---|
| SMILES | CC1=CC(=CC=C1)N2C(=O)/C(=C\C3=CC(=C(C=C3)O)[N+](=O)[O-])/SC2=S |
Product Overview
(5E)-5-(4-hydroxy-3-nitrobenzylidene)-3-(3-methylphenyl)-2-thioxo-1,3-thiazolidin-4-one (CAS 306279-79-8), with molecular formula C17H12N2O4S2 and molecular weight 372.02 g/mol. IUPAC: (5E)-5-[(4-hydroxy-3-nitrophenyl)methylidene]-3-(3-methylphenyl)-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of (5E)-5-(4-hydroxy-3-nitrobenzylidene)-3-(3-methylphenyl)-2-thioxo-1,3-thiazolidin-4-one
Property Insights of (5E)-5-(4-hydroxy-3-nitrobenzylidene)-3-(3-methylphenyl)-2-thioxo-1,3-thiazolidin-4-one
The XLogP value of 4.01462 indicates that (5E)-5-(4-hydroxy-3-nitrobenzylidene)-3-(3-methylphenyl)-2-thioxo-1,3-thiazolidin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.68 Ų falls within the moderate polarity range, balancing permeability and solubility for (5E)-5-(4-hydroxy-3-nitrobenzylidene)-3-(3-methylphenyl)-2-thioxo-1,3-thiazolidin-4-one. Following Lipinski's Rule of Five, (5E)-5-(4-hydroxy-3-nitrobenzylidene)-3-(3-methylphenyl)-2-thioxo-1,3-thiazolidin-4-one has 1 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 (5E)-5-(4-hydroxy-3-nitrobenzylidene)-3-(3-methylphenyl)-2-thioxo-1,3-thiazolidin-4-one?
The CAS number of (5E)-5-(4-hydroxy-3-nitrobenzylidene)-3-(3-methylphenyl)-2-thioxo-1,3-thiazolidin-4-one is 306279-79-8.
What is the molecular formula of (5E)-5-(4-hydroxy-3-nitrobenzylidene)-3-(3-methylphenyl)-2-thioxo-1,3-thiazolidin-4-one?
The molecular formula of (5E)-5-(4-hydroxy-3-nitrobenzylidene)-3-(3-methylphenyl)-2-thioxo-1,3-thiazolidin-4-one is C17H12N2O4S2.
What is the molecular weight of (5E)-5-(4-hydroxy-3-nitrobenzylidene)-3-(3-methylphenyl)-2-thioxo-1,3-thiazolidin-4-one?
The molecular weight of (5E)-5-(4-hydroxy-3-nitrobenzylidene)-3-(3-methylphenyl)-2-thioxo-1,3-thiazolidin-4-one is 372.02 g/mol.
Where can I buy (5E)-5-(4-hydroxy-3-nitrobenzylidene)-3-(3-methylphenyl)-2-thioxo-1,3-thiazolidin-4-one?
You can request a quote for (5E)-5-(4-hydroxy-3-nitrobenzylidene)-3-(3-methylphenyl)-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 (5E)-5-(4-hydroxy-3-nitrobenzylidene)-3-(3-methylphenyl)-2-thioxo-1,3-thiazolidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for (5E)-5-(4-hydroxy-3-nitrobenzylidene)-3-(3-methylphenyl)-2-thioxo-1,3-thiazolidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.