![methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-ethoxy-4-hydroxybenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate structure](/static/products/1164/1164543-23-0.webp)
methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-ethoxy-4-hydroxybenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
TL;DR: methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-ethoxy-4-hydroxybenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate (CAS 1164543-23-0) is a chemical compound with molecular formula C26H29NO7 and molecular weight 467.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-[(3-ethoxy-4-hydroxyphenyl)methylidene]-2-methyl-5-oxopyrrole-3-carboxylate
Also Known As: methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-ethoxy-4-hydroxybenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate, methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-[(3-ethoxy-4-hydroxyphenyl)methylidene]-2-methyl-5-oxopyrrole-3-carboxylate, methyl 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-ethoxy-4-hydroxybenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate, (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-[(3-ethoxy-4-hydroxyphenyl)methylidene]-2-methyl-5-oxo-3-pyrrolecarboxylic acid methyl ester, (4Z)-4-(3-ethoxy-4-hydroxy-benzylidene)-1-homoveratryl-5-keto-2-methyl-2-pyrroline-3-carboxylic acid methyl ester
| Molecular Formula | C26H29NO7 |
|---|---|
| Molecular Weight | 467.19 g/mol |
| LogP | 3.7234 |
| Topological Polar Surface Area | 94.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 467.1944 |
| Heavy Atoms | 34 |
| Complexity | 1149.8333 |
Chemical Identifiers
| CAS Number | 1164543-23-0 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)/C=C\2/C(=C(N(C2=O)CCC3=CC(=C(C=C3)OC)OC)C)C(=O)OC)O |
Product Overview
methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-ethoxy-4-hydroxybenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate (CAS 1164543-23-0), with molecular formula C26H29NO7 and molecular weight 467.19 g/mol. IUPAC: methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-[(3-ethoxy-4-hydroxyphenyl)methylidene]-2-methyl-5-oxopyrrole-3-carboxylate.
Chemical Property Profile of methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-ethoxy-4-hydroxybenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Property Insights of methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-ethoxy-4-hydroxybenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
The XLogP value of 3.7234 indicates that methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-ethoxy-4-hydroxybenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.53 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-ethoxy-4-hydroxybenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate. Following Lipinski's Rule of Five, methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-ethoxy-4-hydroxybenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate has 1 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 methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-ethoxy-4-hydroxybenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate?
The CAS number of methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-ethoxy-4-hydroxybenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate is 1164543-23-0.
What is the molecular formula of methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-ethoxy-4-hydroxybenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate?
The molecular formula of methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-ethoxy-4-hydroxybenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate is C26H29NO7.
What is the molecular weight of methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-ethoxy-4-hydroxybenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate?
The molecular weight of methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-ethoxy-4-hydroxybenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate is 467.19 g/mol.
Where can I buy methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-ethoxy-4-hydroxybenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate?
You can request a quote for methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-ethoxy-4-hydroxybenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-ethoxy-4-hydroxybenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-ethoxy-4-hydroxybenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.