![Methyl 4-[[2-[(2,5-dimethoxyphenyl)methylidene]-3-oxo-benzofuran-6-yl]oxymethyl]benzoate structure](/static/products/858/858760-19-7.png)
Methyl 4-[[2-[(2,5-dimethoxyphenyl)methylidene]-3-oxo-benzofuran-6-yl]oxymethyl]benzoate
TL;DR: Methyl 4-[[2-[(2,5-dimethoxyphenyl)methylidene]-3-oxo-benzofuran-6-yl]oxymethyl]benzoate (CAS 858760-19-7) is a chemical compound with molecular formula C26H22O7 and molecular weight 446.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[[(2Z)-2-[(2,5-dimethoxyphenyl)methylidene]-3-oxo-1-benzofuran-6-yl]oxymethyl]benzoate
Also Known As: Methyl 4-[[2-[(2,5-dimethoxyphenyl)methylidene]-3-oxo-benzofuran-6-yl]oxymethyl]benzoate, (Z)-methyl 4-(((2-(2,5-dimethoxybenzylidene)-3-oxo-2,3-dihydrobenzofuran-6-yl)oxy)methyl)benzoate, methyl 4-({[(2Z)-2-(2,5-dimethoxybenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}methyl)benzoate, methyl 4-({2-[(2,5-dimethoxyphenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yloxy}m ethyl)benzoate, methyl 4-[[(2Z)-2-[(2,5-dimethoxyphenyl)methylidene]-3-oxo-1-benzofuran-6-yl]oxymethyl]benzoate
| Molecular Formula | C26H22O7 |
|---|---|
| Molecular Weight | 446.14 g/mol |
| LogP | 4.6856 |
| Topological Polar Surface Area | 80.29 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 446.13657 |
| Heavy Atoms | 33 |
| Complexity | 1225.8878 |
Chemical Identifiers
| CAS Number | 858760-19-7 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)OC)/C=C\2/C(=O)C3=C(O2)C=C(C=C3)OCC4=CC=C(C=C4)C(=O)OC |
Product Overview
Methyl 4-[[2-[(2,5-dimethoxyphenyl)methylidene]-3-oxo-benzofuran-6-yl]oxymethyl]benzoate (CAS 858760-19-7), with molecular formula C26H22O7 and molecular weight 446.14 g/mol. IUPAC: methyl 4-[[(2Z)-2-[(2,5-dimethoxyphenyl)methylidene]-3-oxo-1-benzofuran-6-yl]oxymethyl]benzoate.
Chemical Property Profile of Methyl 4-[[2-[(2,5-dimethoxyphenyl)methylidene]-3-oxo-benzofuran-6-yl]oxymethyl]benzoate
Property Insights of Methyl 4-[[2-[(2,5-dimethoxyphenyl)methylidene]-3-oxo-benzofuran-6-yl]oxymethyl]benzoate
The XLogP value of 4.6856 indicates that Methyl 4-[[2-[(2,5-dimethoxyphenyl)methylidene]-3-oxo-benzofuran-6-yl]oxymethyl]benzoate 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 Methyl 4-[[2-[(2,5-dimethoxyphenyl)methylidene]-3-oxo-benzofuran-6-yl]oxymethyl]benzoate. Following Lipinski's Rule of Five, Methyl 4-[[2-[(2,5-dimethoxyphenyl)methylidene]-3-oxo-benzofuran-6-yl]oxymethyl]benzoate 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 Methyl 4-[[2-[(2,5-dimethoxyphenyl)methylidene]-3-oxo-benzofuran-6-yl]oxymethyl]benzoate?
The CAS number of Methyl 4-[[2-[(2,5-dimethoxyphenyl)methylidene]-3-oxo-benzofuran-6-yl]oxymethyl]benzoate is 858760-19-7.
What is the molecular formula of Methyl 4-[[2-[(2,5-dimethoxyphenyl)methylidene]-3-oxo-benzofuran-6-yl]oxymethyl]benzoate?
The molecular formula of Methyl 4-[[2-[(2,5-dimethoxyphenyl)methylidene]-3-oxo-benzofuran-6-yl]oxymethyl]benzoate is C26H22O7.
What is the molecular weight of Methyl 4-[[2-[(2,5-dimethoxyphenyl)methylidene]-3-oxo-benzofuran-6-yl]oxymethyl]benzoate?
The molecular weight of Methyl 4-[[2-[(2,5-dimethoxyphenyl)methylidene]-3-oxo-benzofuran-6-yl]oxymethyl]benzoate is 446.14 g/mol.
Where can I buy Methyl 4-[[2-[(2,5-dimethoxyphenyl)methylidene]-3-oxo-benzofuran-6-yl]oxymethyl]benzoate?
You can request a quote for Methyl 4-[[2-[(2,5-dimethoxyphenyl)methylidene]-3-oxo-benzofuran-6-yl]oxymethyl]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-[[2-[(2,5-dimethoxyphenyl)methylidene]-3-oxo-benzofuran-6-yl]oxymethyl]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-[[2-[(2,5-dimethoxyphenyl)methylidene]-3-oxo-benzofuran-6-yl]oxymethyl]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.