(E)-ethyl 2-(5-(3-chloro-5-methoxy-4-(2-methoxy-2-oxoethoxy)benzylidene)-2,4-dioxothiazolidin-3-yl)acetate
TL;DR: (E)-ethyl 2-(5-(3-chloro-5-methoxy-4-(2-methoxy-2-oxoethoxy)benzylidene)-2,4-dioxothiazolidin-3-yl)acetate (CAS 432497-19-3) is a chemical compound with molecular formula C18H18ClNO8S and molecular weight 443.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(5E)-5-[[3-chloro-5-methoxy-4-(2-methoxy-2-oxoethoxy)phenyl]methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]acetate
Also Known As: (E)-ethyl 2-(5-(3-chloro-5-methoxy-4-(2-methoxy-2-oxoethoxy)benzylidene)-2,4-dioxothiazolidin-3-yl)acetate, ethyl 2-[(5E)-5-[[3-chloro-5-methoxy-4-(2-methoxy-2-oxoethoxy)phenyl]methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]acetate, methyl (2-chloro-4-{(E)-[3-(2-ethoxy-2-oxoethyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}-6-methoxyphenoxy)acetate
| Molecular Formula | C18H18ClNO8S |
|---|---|
| Molecular Weight | 443.04 g/mol |
| LogP | 2.4998 |
| Topological Polar Surface Area | 108.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 443.04416 |
| Heavy Atoms | 29 |
| Complexity | 869.66223 |
Chemical Identifiers
| CAS Number | 432497-19-3 |
|---|---|
| SMILES | CCOC(=O)CN1C(=O)/C(=C\C2=CC(=C(C(=C2)Cl)OCC(=O)OC)OC)/SC1=O |
Product Overview
(E)-ethyl 2-(5-(3-chloro-5-methoxy-4-(2-methoxy-2-oxoethoxy)benzylidene)-2,4-dioxothiazolidin-3-yl)acetate (CAS 432497-19-3), with molecular formula C18H18ClNO8S and molecular weight 443.04 g/mol. IUPAC: ethyl 2-[(5E)-5-[[3-chloro-5-methoxy-4-(2-methoxy-2-oxoethoxy)phenyl]methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]acetate.
Chemical Property Profile of (E)-ethyl 2-(5-(3-chloro-5-methoxy-4-(2-methoxy-2-oxoethoxy)benzylidene)-2,4-dioxothiazolidin-3-yl)acetate
Property Insights of (E)-ethyl 2-(5-(3-chloro-5-methoxy-4-(2-methoxy-2-oxoethoxy)benzylidene)-2,4-dioxothiazolidin-3-yl)acetate
The XLogP value of 2.4998 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-ethyl 2-(5-(3-chloro-5-methoxy-4-(2-methoxy-2-oxoethoxy)benzylidene)-2,4-dioxothiazolidin-3-yl)acetate. The TPSA of 108.44 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-ethyl 2-(5-(3-chloro-5-methoxy-4-(2-methoxy-2-oxoethoxy)benzylidene)-2,4-dioxothiazolidin-3-yl)acetate. Following Lipinski's Rule of Five, (E)-ethyl 2-(5-(3-chloro-5-methoxy-4-(2-methoxy-2-oxoethoxy)benzylidene)-2,4-dioxothiazolidin-3-yl)acetate has 0 hydrogen bond donor(s) and 9 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-(3-chloro-5-methoxy-4-(2-methoxy-2-oxoethoxy)benzylidene)-2,4-dioxothiazolidin-3-yl)acetate?
The CAS number of (E)-ethyl 2-(5-(3-chloro-5-methoxy-4-(2-methoxy-2-oxoethoxy)benzylidene)-2,4-dioxothiazolidin-3-yl)acetate is 432497-19-3.
What is the molecular formula of (E)-ethyl 2-(5-(3-chloro-5-methoxy-4-(2-methoxy-2-oxoethoxy)benzylidene)-2,4-dioxothiazolidin-3-yl)acetate?
The molecular formula of (E)-ethyl 2-(5-(3-chloro-5-methoxy-4-(2-methoxy-2-oxoethoxy)benzylidene)-2,4-dioxothiazolidin-3-yl)acetate is C18H18ClNO8S.
What is the molecular weight of (E)-ethyl 2-(5-(3-chloro-5-methoxy-4-(2-methoxy-2-oxoethoxy)benzylidene)-2,4-dioxothiazolidin-3-yl)acetate?
The molecular weight of (E)-ethyl 2-(5-(3-chloro-5-methoxy-4-(2-methoxy-2-oxoethoxy)benzylidene)-2,4-dioxothiazolidin-3-yl)acetate is 443.04 g/mol.
Where can I buy (E)-ethyl 2-(5-(3-chloro-5-methoxy-4-(2-methoxy-2-oxoethoxy)benzylidene)-2,4-dioxothiazolidin-3-yl)acetate?
You can request a quote for (E)-ethyl 2-(5-(3-chloro-5-methoxy-4-(2-methoxy-2-oxoethoxy)benzylidene)-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-(3-chloro-5-methoxy-4-(2-methoxy-2-oxoethoxy)benzylidene)-2,4-dioxothiazolidin-3-yl)acetate?
Yes, KEHONG BIO provides custom synthesis services for (E)-ethyl 2-(5-(3-chloro-5-methoxy-4-(2-methoxy-2-oxoethoxy)benzylidene)-2,4-dioxothiazolidin-3-yl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.