(E)-3-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)-N-(2-hydroxy-2-(4-hydroxyphenyl)ethyl)-N-methylpropanamide
TL;DR: (E)-3-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)-N-(2-hydroxy-2-(4-hydroxyphenyl)ethyl)-N-methylpropanamide (CAS 892638-53-8) is a chemical compound with molecular formula C20H20N2O5S2 and molecular weight 432.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(5E)-5-(furan-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-[2-hydroxy-2-(4-hydroxyphenyl)ethyl]-N-methylpropanamide
Also Known As: (E)-3-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)-N-(2-hydroxy-2-(4-hydroxyphenyl)ethyl)-N-methylpropanamide, 3-[(5E)-5-(furan-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-[2-hydroxy-2-(4-hydroxyphenyl)ethyl]-N-methylpropanamide, 3-[(5E)-5-(furan-2-ylmethylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-[2-hydroxy-2-(4-hydroxyphenyl)ethyl]-N-methylpropanamide
| Molecular Formula | C20H20N2O5S2 |
|---|---|
| Molecular Weight | 432.08 g/mol |
| LogP | 2.7685 |
| Topological Polar Surface Area | 94.22 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 432.08136 |
| Heavy Atoms | 29 |
| Complexity | 924.85803 |
Chemical Identifiers
| CAS Number | 892638-53-8 |
|---|---|
| SMILES | CN(CC(C1=CC=C(C=C1)O)O)C(=O)CCN2C(=O)/C(=C\C3=CC=CO3)/SC2=S |
Product Overview
(E)-3-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)-N-(2-hydroxy-2-(4-hydroxyphenyl)ethyl)-N-methylpropanamide (CAS 892638-53-8), with molecular formula C20H20N2O5S2 and molecular weight 432.08 g/mol. IUPAC: 3-[(5E)-5-(furan-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-[2-hydroxy-2-(4-hydroxyphenyl)ethyl]-N-methylpropanamide.
Chemical Property Profile of (E)-3-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)-N-(2-hydroxy-2-(4-hydroxyphenyl)ethyl)-N-methylpropanamide
Property Insights of (E)-3-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)-N-(2-hydroxy-2-(4-hydroxyphenyl)ethyl)-N-methylpropanamide
The XLogP value of 2.7685 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-3-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)-N-(2-hydroxy-2-(4-hydroxyphenyl)ethyl)-N-methylpropanamide. The TPSA of 94.22 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-3-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)-N-(2-hydroxy-2-(4-hydroxyphenyl)ethyl)-N-methylpropanamide. Following Lipinski's Rule of Five, (E)-3-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)-N-(2-hydroxy-2-(4-hydroxyphenyl)ethyl)-N-methylpropanamide has 2 hydrogen bond donor(s) and 7 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 (E)-3-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)-N-(2-hydroxy-2-(4-hydroxyphenyl)ethyl)-N-methylpropanamide?
The CAS number of (E)-3-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)-N-(2-hydroxy-2-(4-hydroxyphenyl)ethyl)-N-methylpropanamide is 892638-53-8.
What is the molecular formula of (E)-3-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)-N-(2-hydroxy-2-(4-hydroxyphenyl)ethyl)-N-methylpropanamide?
The molecular formula of (E)-3-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)-N-(2-hydroxy-2-(4-hydroxyphenyl)ethyl)-N-methylpropanamide is C20H20N2O5S2.
What is the molecular weight of (E)-3-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)-N-(2-hydroxy-2-(4-hydroxyphenyl)ethyl)-N-methylpropanamide?
The molecular weight of (E)-3-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)-N-(2-hydroxy-2-(4-hydroxyphenyl)ethyl)-N-methylpropanamide is 432.08 g/mol.
Where can I buy (E)-3-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)-N-(2-hydroxy-2-(4-hydroxyphenyl)ethyl)-N-methylpropanamide?
You can request a quote for (E)-3-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)-N-(2-hydroxy-2-(4-hydroxyphenyl)ethyl)-N-methylpropanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-3-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)-N-(2-hydroxy-2-(4-hydroxyphenyl)ethyl)-N-methylpropanamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-3-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)-N-(2-hydroxy-2-(4-hydroxyphenyl)ethyl)-N-methylpropanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.