![5-[4-(1,3-benzodioxol-5-ylmethoxy)-3-methoxybenzylidene]-2-butyl-2-methyl-1,3-dioxane-4,6-dione structure](/static/products/4454/445405-45-8.webp)
5-[4-(1,3-benzodioxol-5-ylmethoxy)-3-methoxybenzylidene]-2-butyl-2-methyl-1,3-dioxane-4,6-dione
TL;DR: 5-[4-(1,3-benzodioxol-5-ylmethoxy)-3-methoxybenzylidene]-2-butyl-2-methyl-1,3-dioxane-4,6-dione (CAS 445405-45-8) is a chemical compound with molecular formula C25H26O8 and molecular weight 454.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[[4-(1,3-benzodioxol-5-ylmethoxy)-3-methoxyphenyl]methylidene]-2-butyl-2-methyl-1,3-dioxane-4,6-dione
Also Known As: 5-[4-(1,3-benzodioxol-5-ylmethoxy)-3-methoxybenzylidene]-2-butyl-2-methyl-1,3-dioxane-4,6-dione, AM-879/15327313, 5-[[4-(1,3-benzodioxol-5-ylmethoxy)-3-methoxyphenyl]methylidene]-2-butyl-2-methyl-1,3-dioxane-4,6-dione, 5-(4-(benzo[d][1,3]dioxol-5-ylmethoxy)-3-methoxybenzylidene)-2-butyl-2-methyl-1,3-dioxane-4,6-dione
| Molecular Formula | C25H26O8 |
|---|---|
| Molecular Weight | 454.16 g/mol |
| LogP | 4.3927 |
| Topological Polar Surface Area | 89.52 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 454.16278 |
| Heavy Atoms | 33 |
| Complexity | 1067.8097 |
Chemical Identifiers
| CAS Number | 445405-45-8 |
|---|---|
| SMILES | CCCCC1(OC(=O)C(=CC2=CC(=C(C=C2)OCC3=CC4=C(C=C3)OCO4)OC)C(=O)O1)C |
Product Overview
5-[4-(1,3-benzodioxol-5-ylmethoxy)-3-methoxybenzylidene]-2-butyl-2-methyl-1,3-dioxane-4,6-dione (CAS 445405-45-8), with molecular formula C25H26O8 and molecular weight 454.16 g/mol. IUPAC: 5-[[4-(1,3-benzodioxol-5-ylmethoxy)-3-methoxyphenyl]methylidene]-2-butyl-2-methyl-1,3-dioxane-4,6-dione.
Chemical Property Profile of 5-[4-(1,3-benzodioxol-5-ylmethoxy)-3-methoxybenzylidene]-2-butyl-2-methyl-1,3-dioxane-4,6-dione
Property Insights of 5-[4-(1,3-benzodioxol-5-ylmethoxy)-3-methoxybenzylidene]-2-butyl-2-methyl-1,3-dioxane-4,6-dione
The XLogP value of 4.3927 indicates that 5-[4-(1,3-benzodioxol-5-ylmethoxy)-3-methoxybenzylidene]-2-butyl-2-methyl-1,3-dioxane-4,6-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.52 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[4-(1,3-benzodioxol-5-ylmethoxy)-3-methoxybenzylidene]-2-butyl-2-methyl-1,3-dioxane-4,6-dione. Following Lipinski's Rule of Five, 5-[4-(1,3-benzodioxol-5-ylmethoxy)-3-methoxybenzylidene]-2-butyl-2-methyl-1,3-dioxane-4,6-dione has 0 hydrogen bond donor(s) and 8 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 5-[4-(1,3-benzodioxol-5-ylmethoxy)-3-methoxybenzylidene]-2-butyl-2-methyl-1,3-dioxane-4,6-dione?
The CAS number of 5-[4-(1,3-benzodioxol-5-ylmethoxy)-3-methoxybenzylidene]-2-butyl-2-methyl-1,3-dioxane-4,6-dione is 445405-45-8.
What is the molecular formula of 5-[4-(1,3-benzodioxol-5-ylmethoxy)-3-methoxybenzylidene]-2-butyl-2-methyl-1,3-dioxane-4,6-dione?
The molecular formula of 5-[4-(1,3-benzodioxol-5-ylmethoxy)-3-methoxybenzylidene]-2-butyl-2-methyl-1,3-dioxane-4,6-dione is C25H26O8.
What is the molecular weight of 5-[4-(1,3-benzodioxol-5-ylmethoxy)-3-methoxybenzylidene]-2-butyl-2-methyl-1,3-dioxane-4,6-dione?
The molecular weight of 5-[4-(1,3-benzodioxol-5-ylmethoxy)-3-methoxybenzylidene]-2-butyl-2-methyl-1,3-dioxane-4,6-dione is 454.16 g/mol.
Where can I buy 5-[4-(1,3-benzodioxol-5-ylmethoxy)-3-methoxybenzylidene]-2-butyl-2-methyl-1,3-dioxane-4,6-dione?
You can request a quote for 5-[4-(1,3-benzodioxol-5-ylmethoxy)-3-methoxybenzylidene]-2-butyl-2-methyl-1,3-dioxane-4,6-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[4-(1,3-benzodioxol-5-ylmethoxy)-3-methoxybenzylidene]-2-butyl-2-methyl-1,3-dioxane-4,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-[4-(1,3-benzodioxol-5-ylmethoxy)-3-methoxybenzylidene]-2-butyl-2-methyl-1,3-dioxane-4,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.