![methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-ethylbenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate structure](/static/products/4729/472983-68-9.webp)
methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-ethylbenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
TL;DR: methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-ethylbenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate (CAS 472983-68-9) is a chemical compound with molecular formula C26H29NO5 and molecular weight 435.20 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-[(4-ethylphenyl)methylidene]-2-methyl-5-oxopyrrole-3-carboxylate
Also Known As: methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-ethylbenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate, (Z)-methyl 1-(3,4-dimethoxyphenethyl)-4-(4-ethylbenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate, methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-[(4-ethylphenyl)methylidene]-2-methyl-5-oxopyrrole-3-carboxylate
| Molecular Formula | C26H29NO5 |
|---|---|
| Molecular Weight | 435.20 g/mol |
| LogP | 4.1815 |
| Topological Polar Surface Area | 65.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 435.20456 |
| Heavy Atoms | 32 |
| Complexity | 1066.1249 |
Chemical Identifiers
| CAS Number | 472983-68-9 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)/C=C\2/C(=C(N(C2=O)CCC3=CC(=C(C=C3)OC)OC)C)C(=O)OC |
Product Overview
methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-ethylbenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate (CAS 472983-68-9), with molecular formula C26H29NO5 and molecular weight 435.20 g/mol. IUPAC: methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-[(4-ethylphenyl)methylidene]-2-methyl-5-oxopyrrole-3-carboxylate.
Chemical Property Profile of methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-ethylbenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Property Insights of methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-ethylbenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
The XLogP value of 4.1815 indicates that methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-ethylbenzylidene)-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 65.07 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-ethylbenzylidene)-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-(4-ethylbenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate has 0 hydrogen bond donor(s) and 5 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-(4-ethylbenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate?
The CAS number of methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-ethylbenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate is 472983-68-9.
What is the molecular formula of methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-ethylbenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate?
The molecular formula of methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-ethylbenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate is C26H29NO5.
What is the molecular weight of methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-ethylbenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate?
The molecular weight of methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-ethylbenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate is 435.20 g/mol.
Where can I buy methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-ethylbenzylidene)-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-(4-ethylbenzylidene)-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-(4-ethylbenzylidene)-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-(4-ethylbenzylidene)-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.