![(4E)-4-[(3-chloro-4-ethoxyphenyl)-hydroxymethylidene]-1-(2-dimethylaminoethyl)-5-thiophen-2-ylpyrrolidine-2,3-dione structure](/static/products/797/797769-57-4.png)
(4E)-4-[(3-chloro-4-ethoxyphenyl)-hydroxymethylidene]-1-(2-dimethylaminoethyl)-5-thiophen-2-ylpyrrolidine-2,3-dione
TL;DR: (4E)-4-[(3-chloro-4-ethoxyphenyl)-hydroxymethylidene]-1-(2-dimethylaminoethyl)-5-thiophen-2-ylpyrrolidine-2,3-dione (CAS 797769-57-4) is a chemical compound with molecular formula C21H23ClN2O4S and molecular weight 434.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[(3-chloro-4-ethoxyphenyl)-hydroxymethylidene]-1-[2-(dimethylamino)ethyl]-5-thiophen-2-ylpyrrolidine-2,3-dione
Also Known As: (4E)-4-[(3-chloro-4-ethoxyphenyl)-hydroxymethylidene]-1-(2-dimethylaminoethyl)-5-thiophen-2-ylpyrrolidine-2,3-dione, 4-(3-chloro-4-ethoxybenzoyl)-1-(2-(dimethylamino)ethyl)-3-hydroxy-5-(thiophen-2-yl)-1H-pyrrol-2(5H)-one
| Molecular Formula | C21H23ClN2O4S |
|---|---|
| Molecular Weight | 434.11 g/mol |
| LogP | 3.7835 |
| Topological Polar Surface Area | 70.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 434.10672 |
| Heavy Atoms | 29 |
| Complexity | 940.16266 |
Chemical Identifiers
| CAS Number | 797769-57-4 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)CCN(C)C)C3=CC=CS3)/O)Cl |
Product Overview
(4E)-4-[(3-chloro-4-ethoxyphenyl)-hydroxymethylidene]-1-(2-dimethylaminoethyl)-5-thiophen-2-ylpyrrolidine-2,3-dione (CAS 797769-57-4), with molecular formula C21H23ClN2O4S and molecular weight 434.11 g/mol. IUPAC: (4E)-4-[(3-chloro-4-ethoxyphenyl)-hydroxymethylidene]-1-[2-(dimethylamino)ethyl]-5-thiophen-2-ylpyrrolidine-2,3-dione.
Chemical Property Profile of (4E)-4-[(3-chloro-4-ethoxyphenyl)-hydroxymethylidene]-1-(2-dimethylaminoethyl)-5-thiophen-2-ylpyrrolidine-2,3-dione
Property Insights of (4E)-4-[(3-chloro-4-ethoxyphenyl)-hydroxymethylidene]-1-(2-dimethylaminoethyl)-5-thiophen-2-ylpyrrolidine-2,3-dione
The XLogP value of 3.7835 indicates that (4E)-4-[(3-chloro-4-ethoxyphenyl)-hydroxymethylidene]-1-(2-dimethylaminoethyl)-5-thiophen-2-ylpyrrolidine-2,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.08 Ų falls within the moderate polarity range, balancing permeability and solubility for (4E)-4-[(3-chloro-4-ethoxyphenyl)-hydroxymethylidene]-1-(2-dimethylaminoethyl)-5-thiophen-2-ylpyrrolidine-2,3-dione. Following Lipinski's Rule of Five, (4E)-4-[(3-chloro-4-ethoxyphenyl)-hydroxymethylidene]-1-(2-dimethylaminoethyl)-5-thiophen-2-ylpyrrolidine-2,3-dione 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 (4E)-4-[(3-chloro-4-ethoxyphenyl)-hydroxymethylidene]-1-(2-dimethylaminoethyl)-5-thiophen-2-ylpyrrolidine-2,3-dione?
The CAS number of (4E)-4-[(3-chloro-4-ethoxyphenyl)-hydroxymethylidene]-1-(2-dimethylaminoethyl)-5-thiophen-2-ylpyrrolidine-2,3-dione is 797769-57-4.
What is the molecular formula of (4E)-4-[(3-chloro-4-ethoxyphenyl)-hydroxymethylidene]-1-(2-dimethylaminoethyl)-5-thiophen-2-ylpyrrolidine-2,3-dione?
The molecular formula of (4E)-4-[(3-chloro-4-ethoxyphenyl)-hydroxymethylidene]-1-(2-dimethylaminoethyl)-5-thiophen-2-ylpyrrolidine-2,3-dione is C21H23ClN2O4S.
What is the molecular weight of (4E)-4-[(3-chloro-4-ethoxyphenyl)-hydroxymethylidene]-1-(2-dimethylaminoethyl)-5-thiophen-2-ylpyrrolidine-2,3-dione?
The molecular weight of (4E)-4-[(3-chloro-4-ethoxyphenyl)-hydroxymethylidene]-1-(2-dimethylaminoethyl)-5-thiophen-2-ylpyrrolidine-2,3-dione is 434.11 g/mol.
Where can I buy (4E)-4-[(3-chloro-4-ethoxyphenyl)-hydroxymethylidene]-1-(2-dimethylaminoethyl)-5-thiophen-2-ylpyrrolidine-2,3-dione?
You can request a quote for (4E)-4-[(3-chloro-4-ethoxyphenyl)-hydroxymethylidene]-1-(2-dimethylaminoethyl)-5-thiophen-2-ylpyrrolidine-2,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4E)-4-[(3-chloro-4-ethoxyphenyl)-hydroxymethylidene]-1-(2-dimethylaminoethyl)-5-thiophen-2-ylpyrrolidine-2,3-dione?
Yes, KEHONG BIO provides custom synthesis services for (4E)-4-[(3-chloro-4-ethoxyphenyl)-hydroxymethylidene]-1-(2-dimethylaminoethyl)-5-thiophen-2-ylpyrrolidine-2,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.