(E)-ethyl 2-(5-(5-bromo-2-methoxybenzylidene)-2,4-dioxothiazolidin-3-yl)acetate
TL;DR: (E)-ethyl 2-(5-(5-bromo-2-methoxybenzylidene)-2,4-dioxothiazolidin-3-yl)acetate (CAS 432007-72-2) is a chemical compound with molecular formula C15H14BrNO5S and molecular weight 398.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(5E)-5-[(5-bromo-2-methoxyphenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]acetate
Also Known As: (E)-ethyl 2-(5-(5-bromo-2-methoxybenzylidene)-2,4-dioxothiazolidin-3-yl)acetate, ethyl [(5E)-5-(5-bromo-2-methoxybenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]acetate, ethyl 2-{5-[(5-bromo-2-methoxyphenyl)methylene]-2,4-dioxo-1,3-thiazolidin-3-yl }acetate, ethyl 2-[(5E)-5-[(5-bromo-2-methoxyphenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]acetate
| Molecular Formula | C15H14BrNO5S |
|---|---|
| Molecular Weight | 398.98 g/mol |
| LogP | 3.0571 |
| Topological Polar Surface Area | 72.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 398.9776 |
| Heavy Atoms | 23 |
| Complexity | 688.4448 |
Chemical Identifiers
| CAS Number | 432007-72-2 |
|---|---|
| SMILES | CCOC(=O)CN1C(=O)/C(=C\C2=C(C=CC(=C2)Br)OC)/SC1=O |
Product Overview
(E)-ethyl 2-(5-(5-bromo-2-methoxybenzylidene)-2,4-dioxothiazolidin-3-yl)acetate (CAS 432007-72-2), with molecular formula C15H14BrNO5S and molecular weight 398.98 g/mol. IUPAC: ethyl 2-[(5E)-5-[(5-bromo-2-methoxyphenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]acetate.
Chemical Property Profile of (E)-ethyl 2-(5-(5-bromo-2-methoxybenzylidene)-2,4-dioxothiazolidin-3-yl)acetate
Property Insights of (E)-ethyl 2-(5-(5-bromo-2-methoxybenzylidene)-2,4-dioxothiazolidin-3-yl)acetate
The XLogP value of 3.0571 indicates that (E)-ethyl 2-(5-(5-bromo-2-methoxybenzylidene)-2,4-dioxothiazolidin-3-yl)acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.91 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-ethyl 2-(5-(5-bromo-2-methoxybenzylidene)-2,4-dioxothiazolidin-3-yl)acetate. Following Lipinski's Rule of Five, (E)-ethyl 2-(5-(5-bromo-2-methoxybenzylidene)-2,4-dioxothiazolidin-3-yl)acetate has 0 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 (E)-ethyl 2-(5-(5-bromo-2-methoxybenzylidene)-2,4-dioxothiazolidin-3-yl)acetate?
The CAS number of (E)-ethyl 2-(5-(5-bromo-2-methoxybenzylidene)-2,4-dioxothiazolidin-3-yl)acetate is 432007-72-2.
What is the molecular formula of (E)-ethyl 2-(5-(5-bromo-2-methoxybenzylidene)-2,4-dioxothiazolidin-3-yl)acetate?
The molecular formula of (E)-ethyl 2-(5-(5-bromo-2-methoxybenzylidene)-2,4-dioxothiazolidin-3-yl)acetate is C15H14BrNO5S.
What is the molecular weight of (E)-ethyl 2-(5-(5-bromo-2-methoxybenzylidene)-2,4-dioxothiazolidin-3-yl)acetate?
The molecular weight of (E)-ethyl 2-(5-(5-bromo-2-methoxybenzylidene)-2,4-dioxothiazolidin-3-yl)acetate is 398.98 g/mol.
Where can I buy (E)-ethyl 2-(5-(5-bromo-2-methoxybenzylidene)-2,4-dioxothiazolidin-3-yl)acetate?
You can request a quote for (E)-ethyl 2-(5-(5-bromo-2-methoxybenzylidene)-2,4-dioxothiazolidin-3-yl)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-ethyl 2-(5-(5-bromo-2-methoxybenzylidene)-2,4-dioxothiazolidin-3-yl)acetate?
Yes, KEHONG BIO provides custom synthesis services for (E)-ethyl 2-(5-(5-bromo-2-methoxybenzylidene)-2,4-dioxothiazolidin-3-yl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.