(5E)-3-ethyl-5-({[2-(morpholin-4-yl)ethyl]amino}methylidene)-2-thioxo-1,3-thiazolidin-4-one
TL;DR: (5E)-3-ethyl-5-({[2-(morpholin-4-yl)ethyl]amino}methylidene)-2-thioxo-1,3-thiazolidin-4-one (CAS 1164543-07-0) is a chemical compound with molecular formula C12H19N3O2S2 and molecular weight 301.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethyl-4-hydroxy-5-(2-morpholin-4-ylethyliminomethyl)-1,3-thiazole-2-thione
Also Known As: (5E)-3-ethyl-5-({[2-(morpholin-4-yl)ethyl]amino}methylidene)-2-thioxo-1,3-thiazolidin-4-one, (E)-3-ethyl-5-(((2-morpholinoethyl)amino)methylene)-2-thioxothiazolidin-4-one, 3-ethyl-5-[(2-morpholin-4-ylethylamino)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one, 3-ethyl-5-{[(2-morpholin-4-ylethyl)amino]methylene}-2-thioxo-1,3-thiazolidin-4 -one, (5E)-3-ETHYL-5-({[2-(MORPHOLIN-4-YL)ETHYL]AMINO}METHYLIDENE)-2-SULFANYLIDENE-1,3-THIAZOLIDIN-4-ONE
| Molecular Formula | C12H19N3O2S2 |
|---|---|
| Molecular Weight | 301.09 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 106.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 301.09186 |
| Heavy Atoms | 19 |
| Complexity | 392.0 |
Chemical Identifiers
| CAS Number | 1164543-07-0 |
|---|---|
| SMILES | CCN1C(=C(SC1=S)C=NCCN2CCOCC2)O |
| InChIKey | HGOQKAPRYTXBEK-UHFFFAOYSA-N |
Product Overview
(5E)-3-ethyl-5-({[2-(morpholin-4-yl)ethyl]amino}methylidene)-2-thioxo-1,3-thiazolidin-4-one (CAS 1164543-07-0), with molecular formula C12H19N3O2S2 and molecular weight 301.09 g/mol. IUPAC: 3-ethyl-4-hydroxy-5-(2-morpholin-4-ylethyliminomethyl)-1,3-thiazole-2-thione.
Chemical Property Profile of (5E)-3-ethyl-5-({[2-(morpholin-4-yl)ethyl]amino}methylidene)-2-thioxo-1,3-thiazolidin-4-one
Property Insights of (5E)-3-ethyl-5-({[2-(morpholin-4-yl)ethyl]amino}methylidene)-2-thioxo-1,3-thiazolidin-4-one
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5E)-3-ethyl-5-({[2-(morpholin-4-yl)ethyl]amino}methylidene)-2-thioxo-1,3-thiazolidin-4-one. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (5E)-3-ethyl-5-({[2-(morpholin-4-yl)ethyl]amino}methylidene)-2-thioxo-1,3-thiazolidin-4-one. Following Lipinski's Rule of Five, (5E)-3-ethyl-5-({[2-(morpholin-4-yl)ethyl]amino}methylidene)-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)-3-ethyl-5-({[2-(morpholin-4-yl)ethyl]amino}methylidene)-2-thioxo-1,3-thiazolidin-4-one?
The CAS number of (5E)-3-ethyl-5-({[2-(morpholin-4-yl)ethyl]amino}methylidene)-2-thioxo-1,3-thiazolidin-4-one is 1164543-07-0.
What is the molecular formula of (5E)-3-ethyl-5-({[2-(morpholin-4-yl)ethyl]amino}methylidene)-2-thioxo-1,3-thiazolidin-4-one?
The molecular formula of (5E)-3-ethyl-5-({[2-(morpholin-4-yl)ethyl]amino}methylidene)-2-thioxo-1,3-thiazolidin-4-one is C12H19N3O2S2.
What is the molecular weight of (5E)-3-ethyl-5-({[2-(morpholin-4-yl)ethyl]amino}methylidene)-2-thioxo-1,3-thiazolidin-4-one?
The molecular weight of (5E)-3-ethyl-5-({[2-(morpholin-4-yl)ethyl]amino}methylidene)-2-thioxo-1,3-thiazolidin-4-one is 301.09 g/mol.
Where can I buy (5E)-3-ethyl-5-({[2-(morpholin-4-yl)ethyl]amino}methylidene)-2-thioxo-1,3-thiazolidin-4-one?
You can request a quote for (5E)-3-ethyl-5-({[2-(morpholin-4-yl)ethyl]amino}methylidene)-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)-3-ethyl-5-({[2-(morpholin-4-yl)ethyl]amino}methylidene)-2-thioxo-1,3-thiazolidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for (5E)-3-ethyl-5-({[2-(morpholin-4-yl)ethyl]amino}methylidene)-2-thioxo-1,3-thiazolidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.