(5Z)-5-(3-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one
TL;DR: (5Z)-5-(3-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one (CAS 6301-12-8) is a chemical compound with molecular formula C10H6N2O3S2 and molecular weight 265.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[(3-nitrophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: ATPase-IN-3, 5-(3-nitrobenzylidene)-2-thioxo-1,3-thiazolan-4-one, (5Z)-5-(3-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one, J1.070.067A, 5-(m-Nitrobenzylidene)-2-thioxothiazolidine-4-one
| Molecular Formula | C10H6N2O3S2 |
|---|---|
| Molecular Weight | 265.98 g/mol |
| LogP | 2.0836 |
| Topological Polar Surface Area | 72.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 265.982 |
| Heavy Atoms | 17 |
| Complexity | 554.23694 |
Chemical Identifiers
| CAS Number | 6301-12-8 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])/C=C\2/C(=O)NC(=S)S2 |
Product Overview
(5Z)-5-(3-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one (CAS 6301-12-8), with molecular formula C10H6N2O3S2 and molecular weight 265.98 g/mol. IUPAC: (5Z)-5-[(3-nitrophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of (5Z)-5-(3-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one
Property Insights of (5Z)-5-(3-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one
The XLogP value of 2.0836 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5Z)-5-(3-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one. The TPSA of 72.24 Ų falls within the moderate polarity range, balancing permeability and solubility for (5Z)-5-(3-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one. Following Lipinski's Rule of Five, (5Z)-5-(3-nitrobenzylidene)-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 (5Z)-5-(3-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one?
The CAS number of (5Z)-5-(3-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one is 6301-12-8.
What is the molecular formula of (5Z)-5-(3-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one?
The molecular formula of (5Z)-5-(3-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one is C10H6N2O3S2.
What is the molecular weight of (5Z)-5-(3-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one?
The molecular weight of (5Z)-5-(3-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one is 265.98 g/mol.
Where can I buy (5Z)-5-(3-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one?
You can request a quote for (5Z)-5-(3-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)-5-(3-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for (5Z)-5-(3-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.