![2-[5-[(4-Methoxyphenyl)methylene]-3-methyl-4-oxo-2-thiazolidinylidene]-3-oxopropanenitrile structure](/static/products/852/852706-18-4.png)
2-[5-[(4-Methoxyphenyl)methylene]-3-methyl-4-oxo-2-thiazolidinylidene]-3-oxopropanenitrile
TL;DR: 2-[5-[(4-Methoxyphenyl)methylene]-3-methyl-4-oxo-2-thiazolidinylidene]-3-oxopropanenitrile (CAS 852706-18-4) is a chemical compound with molecular formula C15H12N2O3S and molecular weight 300.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[5-[(4-methoxyphenyl)methylidene]-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene]-3-oxopropanenitrile
Also Known As: 2-[5-[(4-Methoxyphenyl)methylene]-3-methyl-4-oxo-2-thiazolidinylidene]-3-oxopropanenitrile, 2-[5-[(4-methoxyphenyl)methylidene]-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene]-3-oxopropanenitrile, 2-{5-[(4-methoxyphenyl)methylidene]-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene}-3-oxopropanenitrile
| Molecular Formula | C15H12N2O3S |
|---|---|
| Molecular Weight | 300.06 g/mol |
| LogP | 0.15738 |
| Topological Polar Surface Area | 72.09 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 300.05685 |
| Heavy Atoms | 21 |
| Complexity | 882.97064 |
Chemical Identifiers
| CAS Number | 852706-18-4 |
|---|---|
| SMILES | CN1C(=O)C(=CC2=CC=C(C=C2)OC)SC1=C(C=O)C#N |
Product Overview
2-[5-[(4-Methoxyphenyl)methylene]-3-methyl-4-oxo-2-thiazolidinylidene]-3-oxopropanenitrile (CAS 852706-18-4), with molecular formula C15H12N2O3S and molecular weight 300.06 g/mol. IUPAC: 2-[5-[(4-methoxyphenyl)methylidene]-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene]-3-oxopropanenitrile.
Chemical Property Profile of 2-[5-[(4-Methoxyphenyl)methylene]-3-methyl-4-oxo-2-thiazolidinylidene]-3-oxopropanenitrile
Property Insights of 2-[5-[(4-Methoxyphenyl)methylene]-3-methyl-4-oxo-2-thiazolidinylidene]-3-oxopropanenitrile
The XLogP value of 0.15738 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[5-[(4-Methoxyphenyl)methylene]-3-methyl-4-oxo-2-thiazolidinylidene]-3-oxopropanenitrile. The TPSA of 72.09 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[5-[(4-Methoxyphenyl)methylene]-3-methyl-4-oxo-2-thiazolidinylidene]-3-oxopropanenitrile. Following Lipinski's Rule of Five, 2-[5-[(4-Methoxyphenyl)methylene]-3-methyl-4-oxo-2-thiazolidinylidene]-3-oxopropanenitrile has 0 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 2-[5-[(4-Methoxyphenyl)methylene]-3-methyl-4-oxo-2-thiazolidinylidene]-3-oxopropanenitrile?
The CAS number of 2-[5-[(4-Methoxyphenyl)methylene]-3-methyl-4-oxo-2-thiazolidinylidene]-3-oxopropanenitrile is 852706-18-4.
What is the molecular formula of 2-[5-[(4-Methoxyphenyl)methylene]-3-methyl-4-oxo-2-thiazolidinylidene]-3-oxopropanenitrile?
The molecular formula of 2-[5-[(4-Methoxyphenyl)methylene]-3-methyl-4-oxo-2-thiazolidinylidene]-3-oxopropanenitrile is C15H12N2O3S.
What is the molecular weight of 2-[5-[(4-Methoxyphenyl)methylene]-3-methyl-4-oxo-2-thiazolidinylidene]-3-oxopropanenitrile?
The molecular weight of 2-[5-[(4-Methoxyphenyl)methylene]-3-methyl-4-oxo-2-thiazolidinylidene]-3-oxopropanenitrile is 300.06 g/mol.
Where can I buy 2-[5-[(4-Methoxyphenyl)methylene]-3-methyl-4-oxo-2-thiazolidinylidene]-3-oxopropanenitrile?
You can request a quote for 2-[5-[(4-Methoxyphenyl)methylene]-3-methyl-4-oxo-2-thiazolidinylidene]-3-oxopropanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[5-[(4-Methoxyphenyl)methylene]-3-methyl-4-oxo-2-thiazolidinylidene]-3-oxopropanenitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[5-[(4-Methoxyphenyl)methylene]-3-methyl-4-oxo-2-thiazolidinylidene]-3-oxopropanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.