Ethyl (E)-2-((E)-5-((5-methylthiophen-2-yl)methylene)-4-oxothiazolidin-2-ylidene)acetate
TL;DR: Ethyl (E)-2-((E)-5-((5-methylthiophen-2-yl)methylene)-4-oxothiazolidin-2-ylidene)acetate (CAS 1351358-93-4) is a chemical compound with molecular formula C13H13NO3S2 and molecular weight 295.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[5-[(5-methylthiophen-2-yl)methylidene]-4-oxo-1,3-thiazolidin-2-ylidene]acetate
Also Known As: Ethyl (E)-2-((E)-5-((5-methylthiophen-2-yl)methylene)-4-oxothiazolidin-2-ylidene)acetate, ethyl 2-[5-[(5-methylthiophen-2-yl)methylidene]-4-oxo-1,3-thiazolidin-2-ylidene]acetate, ethyl 2-{5-[(5-methylthiophen-2-yl)methylidene]-4-oxo-1,3-thiazolidin-2-ylidene}acetate
| Molecular Formula | C13H13NO3S2 |
|---|---|
| Molecular Weight | 295.03 g/mol |
| LogP | 0.97872 |
| Topological Polar Surface Area | 59.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 295.0337 |
| Heavy Atoms | 19 |
| Complexity | 751.4357 |
Chemical Identifiers
| CAS Number | 1351358-93-4 |
|---|---|
| SMILES | CCOC(=O)C=C1NC(=O)C(=CC2=CC=C(S2)C)S1 |
Product Overview
Ethyl (E)-2-((E)-5-((5-methylthiophen-2-yl)methylene)-4-oxothiazolidin-2-ylidene)acetate (CAS 1351358-93-4), with molecular formula C13H13NO3S2 and molecular weight 295.03 g/mol. IUPAC: ethyl 2-[5-[(5-methylthiophen-2-yl)methylidene]-4-oxo-1,3-thiazolidin-2-ylidene]acetate.
Chemical Property Profile of Ethyl (E)-2-((E)-5-((5-methylthiophen-2-yl)methylene)-4-oxothiazolidin-2-ylidene)acetate
Property Insights of Ethyl (E)-2-((E)-5-((5-methylthiophen-2-yl)methylene)-4-oxothiazolidin-2-ylidene)acetate
The XLogP value of 0.97872 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl (E)-2-((E)-5-((5-methylthiophen-2-yl)methylene)-4-oxothiazolidin-2-ylidene)acetate. With a topological polar surface area (TPSA) of 59.16 Ų, Ethyl (E)-2-((E)-5-((5-methylthiophen-2-yl)methylene)-4-oxothiazolidin-2-ylidene)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl (E)-2-((E)-5-((5-methylthiophen-2-yl)methylene)-4-oxothiazolidin-2-ylidene)acetate 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 Ethyl (E)-2-((E)-5-((5-methylthiophen-2-yl)methylene)-4-oxothiazolidin-2-ylidene)acetate?
The CAS number of Ethyl (E)-2-((E)-5-((5-methylthiophen-2-yl)methylene)-4-oxothiazolidin-2-ylidene)acetate is 1351358-93-4.
What is the molecular formula of Ethyl (E)-2-((E)-5-((5-methylthiophen-2-yl)methylene)-4-oxothiazolidin-2-ylidene)acetate?
The molecular formula of Ethyl (E)-2-((E)-5-((5-methylthiophen-2-yl)methylene)-4-oxothiazolidin-2-ylidene)acetate is C13H13NO3S2.
What is the molecular weight of Ethyl (E)-2-((E)-5-((5-methylthiophen-2-yl)methylene)-4-oxothiazolidin-2-ylidene)acetate?
The molecular weight of Ethyl (E)-2-((E)-5-((5-methylthiophen-2-yl)methylene)-4-oxothiazolidin-2-ylidene)acetate is 295.03 g/mol.
Where can I buy Ethyl (E)-2-((E)-5-((5-methylthiophen-2-yl)methylene)-4-oxothiazolidin-2-ylidene)acetate?
You can request a quote for Ethyl (E)-2-((E)-5-((5-methylthiophen-2-yl)methylene)-4-oxothiazolidin-2-ylidene)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl (E)-2-((E)-5-((5-methylthiophen-2-yl)methylene)-4-oxothiazolidin-2-ylidene)acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl (E)-2-((E)-5-((5-methylthiophen-2-yl)methylene)-4-oxothiazolidin-2-ylidene)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.