![[7-methyl-3-oxo-2-[(3,4,5-trimethoxyphenyl)methylidene]benzofuran-6-yl] 2-fluorobenzoate structure](/static/products/859/859133-91-8.png)
[7-methyl-3-oxo-2-[(3,4,5-trimethoxyphenyl)methylidene]benzofuran-6-yl] 2-fluorobenzoate
TL;DR: [7-methyl-3-oxo-2-[(3,4,5-trimethoxyphenyl)methylidene]benzofuran-6-yl] 2-fluorobenzoate (CAS 859133-91-8) is a chemical compound with molecular formula C26H21FO7 and molecular weight 464.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2Z)-7-methyl-3-oxo-2-[(3,4,5-trimethoxyphenyl)methylidene]-1-benzofuran-6-yl] 2-fluorobenzoate
Also Known As: [7-methyl-3-oxo-2-[(3,4,5-trimethoxyphenyl)methylidene]benzofuran-6-yl] 2-fluorobenzoate|(2Z)-7-methyl-3-oxo-2-(3,4,5-trimethoxybenzylidene)-2,3-dihydro-1-benzofuran-6-yl 2-fluorobenzoate|(Z)-7-methyl-3-oxo-2-(3,4,5-trimethoxybenzylidene)-2,3-dihydrobenzofuran-6-yl 2-fluorobenzoate|[(2Z)-7-methyl-3-oxo-2-[(3,4,5-trimethoxyphenyl)methylidene]-1-benzofuran-6-yl] 2-fluorobenzoate|7-methyl-3-oxo-2-[(3,4,5-trimethoxyphenyl)methylene]benzo[3,4-b]furan-6-yl 2-f luorobenzoate
| Molecular Formula | C26H21FO7 |
|---|---|
| Molecular Weight | 464.13 g/mol |
| LogP | 4.99532 |
| Topological Polar Surface Area | 80.29 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 464.12714 |
| Heavy Atoms | 34 |
| Complexity | 1301.7147 |
Chemical Identifiers
| CAS Number | 859133-91-8 |
|---|---|
| SMILES | CC1=C(C=CC2=C1O/C(=C\C3=CC(=C(C(=C3)OC)OC)OC)/C2=O)OC(=O)C4=CC=CC=C4F |
Product Overview
[7-methyl-3-oxo-2-[(3,4,5-trimethoxyphenyl)methylidene]benzofuran-6-yl] 2-fluorobenzoate (CAS 859133-91-8), with molecular formula C26H21FO7 and molecular weight 464.13 g/mol. IUPAC: [(2Z)-7-methyl-3-oxo-2-[(3,4,5-trimethoxyphenyl)methylidene]-1-benzofuran-6-yl] 2-fluorobenzoate.
Chemical Property Profile of [7-methyl-3-oxo-2-[(3,4,5-trimethoxyphenyl)methylidene]benzofuran-6-yl] 2-fluorobenzoate
Property Insights of [7-methyl-3-oxo-2-[(3,4,5-trimethoxyphenyl)methylidene]benzofuran-6-yl] 2-fluorobenzoate
The XLogP value of 4.99532 indicates that [7-methyl-3-oxo-2-[(3,4,5-trimethoxyphenyl)methylidene]benzofuran-6-yl] 2-fluorobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.29 Ų falls within the moderate polarity range, balancing permeability and solubility for [7-methyl-3-oxo-2-[(3,4,5-trimethoxyphenyl)methylidene]benzofuran-6-yl] 2-fluorobenzoate. Following Lipinski's Rule of Five, [7-methyl-3-oxo-2-[(3,4,5-trimethoxyphenyl)methylidene]benzofuran-6-yl] 2-fluorobenzoate has 0 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 [7-methyl-3-oxo-2-[(3,4,5-trimethoxyphenyl)methylidene]benzofuran-6-yl] 2-fluorobenzoate?
The CAS number of [7-methyl-3-oxo-2-[(3,4,5-trimethoxyphenyl)methylidene]benzofuran-6-yl] 2-fluorobenzoate is 859133-91-8.
What is the molecular formula of [7-methyl-3-oxo-2-[(3,4,5-trimethoxyphenyl)methylidene]benzofuran-6-yl] 2-fluorobenzoate?
The molecular formula of [7-methyl-3-oxo-2-[(3,4,5-trimethoxyphenyl)methylidene]benzofuran-6-yl] 2-fluorobenzoate is C26H21FO7.
What is the molecular weight of [7-methyl-3-oxo-2-[(3,4,5-trimethoxyphenyl)methylidene]benzofuran-6-yl] 2-fluorobenzoate?
The molecular weight of [7-methyl-3-oxo-2-[(3,4,5-trimethoxyphenyl)methylidene]benzofuran-6-yl] 2-fluorobenzoate is 464.13 g/mol.
Where can I buy [7-methyl-3-oxo-2-[(3,4,5-trimethoxyphenyl)methylidene]benzofuran-6-yl] 2-fluorobenzoate?
You can request a quote for [7-methyl-3-oxo-2-[(3,4,5-trimethoxyphenyl)methylidene]benzofuran-6-yl] 2-fluorobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [7-methyl-3-oxo-2-[(3,4,5-trimethoxyphenyl)methylidene]benzofuran-6-yl] 2-fluorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for [7-methyl-3-oxo-2-[(3,4,5-trimethoxyphenyl)methylidene]benzofuran-6-yl] 2-fluorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.