5-((1H-Indol-3-yl)methylene)-3-ethyl-2-thioxothiazolidin-4-one
TL;DR: 5-((1H-Indol-3-yl)methylene)-3-ethyl-2-thioxothiazolidin-4-one (CAS 92148-90-8) is a chemical compound with molecular formula C14H12N2OS2 and molecular weight 288.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethyl-4-hydroxy-5-(indol-3-ylidenemethyl)-1,3-thiazole-2-thione
Also Known As: 3-Ethyl-5-(1H-indol-3-ylmethylene)-2-thioxo-thiazolidin-4-one, 5-((1H-Indol-3-yl)methylene)-3-ethyl-2-thioxothiazolidin-4-one, (Z)-5-((1H-indol-3-yl)methylene)-3-ethyl-2-thioxothiazolidin-4-one, 3-ETHYL-5-(INDOL-3-YLMETHYLENE)-2-THIOXO-1,3-THIAZOLIDIN-4-ONE, 3-ethyl-5-[(E)-1H-indol-3-ylmethylidene]-2-thioxo-1,3-thiazolan-4-one
| Molecular Formula | C14H12N2OS2 |
|---|---|
| Molecular Weight | 288.04 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 93.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 288.0391 |
| Heavy Atoms | 19 |
| Complexity | 496.0 |
Chemical Identifiers
| CAS Number | 92148-90-8 |
|---|---|
| SMILES | CCN1C(=C(SC1=S)C=C2C=NC3=CC=CC=C32)O |
| InChIKey | BYZDFSNRACWQHG-UHFFFAOYSA-N |
Product Overview
5-((1H-Indol-3-yl)methylene)-3-ethyl-2-thioxothiazolidin-4-one (CAS 92148-90-8), with molecular formula C14H12N2OS2 and molecular weight 288.04 g/mol. IUPAC: 3-ethyl-4-hydroxy-5-(indol-3-ylidenemethyl)-1,3-thiazole-2-thione.
Chemical Property Profile of 5-((1H-Indol-3-yl)methylene)-3-ethyl-2-thioxothiazolidin-4-one
Property Insights of 5-((1H-Indol-3-yl)methylene)-3-ethyl-2-thioxothiazolidin-4-one
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-((1H-Indol-3-yl)methylene)-3-ethyl-2-thioxothiazolidin-4-one. The TPSA of 93.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-((1H-Indol-3-yl)methylene)-3-ethyl-2-thioxothiazolidin-4-one. Following Lipinski's Rule of Five, 5-((1H-Indol-3-yl)methylene)-3-ethyl-2-thioxothiazolidin-4-one has 1 hydrogen bond donor(s) and 4 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 5-((1H-Indol-3-yl)methylene)-3-ethyl-2-thioxothiazolidin-4-one?
The CAS number of 5-((1H-Indol-3-yl)methylene)-3-ethyl-2-thioxothiazolidin-4-one is 92148-90-8.
What is the molecular formula of 5-((1H-Indol-3-yl)methylene)-3-ethyl-2-thioxothiazolidin-4-one?
The molecular formula of 5-((1H-Indol-3-yl)methylene)-3-ethyl-2-thioxothiazolidin-4-one is C14H12N2OS2.
What is the molecular weight of 5-((1H-Indol-3-yl)methylene)-3-ethyl-2-thioxothiazolidin-4-one?
The molecular weight of 5-((1H-Indol-3-yl)methylene)-3-ethyl-2-thioxothiazolidin-4-one is 288.04 g/mol.
Where can I buy 5-((1H-Indol-3-yl)methylene)-3-ethyl-2-thioxothiazolidin-4-one?
You can request a quote for 5-((1H-Indol-3-yl)methylene)-3-ethyl-2-thioxothiazolidin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-((1H-Indol-3-yl)methylene)-3-ethyl-2-thioxothiazolidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 5-((1H-Indol-3-yl)methylene)-3-ethyl-2-thioxothiazolidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.