5-{[5-(4-acetylphenyl)-2-furyl]methylene}-2-tert-butyl-2-methyl-1,3-dioxane-4,6-dione
TL;DR: 5-{[5-(4-acetylphenyl)-2-furyl]methylene}-2-tert-butyl-2-methyl-1,3-dioxane-4,6-dione (CAS 425632-82-2) is a chemical compound with molecular formula C22H22O6 and molecular weight 382.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[[5-(4-acetylphenyl)furan-2-yl]methylidene]-2-tert-butyl-2-methyl-1,3-dioxane-4,6-dione
Also Known As: 5-{[5-(4-acetylphenyl)-2-furyl]methylene}-2-tert-butyl-2-methyl-1,3-dioxane-4,6-dione, 5-((5-(4-acetylphenyl)furan-2-yl)methylene)-2-(tert-butyl)-2-methyl-1,3-dioxane-4,6-dione, 5-[[5-(4-acetylphenyl)furan-2-yl]methylidene]-2-tert-butyl-2-methyl-1,3-dioxane-4,6-dione, 5-{[5-(4-acetylphenyl)furan-2-yl]methylidene}-2-tert-butyl-2-methyl-1,3-dioxane-4,6-dione
| Molecular Formula | C22H22O6 |
|---|---|
| Molecular Weight | 382.14 g/mol |
| LogP | 4.3949 |
| Topological Polar Surface Area | 82.81 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 382.14163 |
| Heavy Atoms | 28 |
| Complexity | 949.20105 |
Chemical Identifiers
| CAS Number | 425632-82-2 |
|---|---|
| SMILES | CC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=C3C(=O)OC(OC3=O)(C)C(C)(C)C |
Product Overview
5-{[5-(4-acetylphenyl)-2-furyl]methylene}-2-tert-butyl-2-methyl-1,3-dioxane-4,6-dione (CAS 425632-82-2), with molecular formula C22H22O6 and molecular weight 382.14 g/mol. IUPAC: 5-[[5-(4-acetylphenyl)furan-2-yl]methylidene]-2-tert-butyl-2-methyl-1,3-dioxane-4,6-dione.
Chemical Property Profile of 5-{[5-(4-acetylphenyl)-2-furyl]methylene}-2-tert-butyl-2-methyl-1,3-dioxane-4,6-dione
Property Insights of 5-{[5-(4-acetylphenyl)-2-furyl]methylene}-2-tert-butyl-2-methyl-1,3-dioxane-4,6-dione
The XLogP value of 4.3949 indicates that 5-{[5-(4-acetylphenyl)-2-furyl]methylene}-2-tert-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 82.81 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-{[5-(4-acetylphenyl)-2-furyl]methylene}-2-tert-butyl-2-methyl-1,3-dioxane-4,6-dione. Following Lipinski's Rule of Five, 5-{[5-(4-acetylphenyl)-2-furyl]methylene}-2-tert-butyl-2-methyl-1,3-dioxane-4,6-dione has 0 hydrogen bond donor(s) and 6 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-{[5-(4-acetylphenyl)-2-furyl]methylene}-2-tert-butyl-2-methyl-1,3-dioxane-4,6-dione?
The CAS number of 5-{[5-(4-acetylphenyl)-2-furyl]methylene}-2-tert-butyl-2-methyl-1,3-dioxane-4,6-dione is 425632-82-2.
What is the molecular formula of 5-{[5-(4-acetylphenyl)-2-furyl]methylene}-2-tert-butyl-2-methyl-1,3-dioxane-4,6-dione?
The molecular formula of 5-{[5-(4-acetylphenyl)-2-furyl]methylene}-2-tert-butyl-2-methyl-1,3-dioxane-4,6-dione is C22H22O6.
What is the molecular weight of 5-{[5-(4-acetylphenyl)-2-furyl]methylene}-2-tert-butyl-2-methyl-1,3-dioxane-4,6-dione?
The molecular weight of 5-{[5-(4-acetylphenyl)-2-furyl]methylene}-2-tert-butyl-2-methyl-1,3-dioxane-4,6-dione is 382.14 g/mol.
Where can I buy 5-{[5-(4-acetylphenyl)-2-furyl]methylene}-2-tert-butyl-2-methyl-1,3-dioxane-4,6-dione?
You can request a quote for 5-{[5-(4-acetylphenyl)-2-furyl]methylene}-2-tert-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-{[5-(4-acetylphenyl)-2-furyl]methylene}-2-tert-butyl-2-methyl-1,3-dioxane-4,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-{[5-(4-acetylphenyl)-2-furyl]methylene}-2-tert-butyl-2-methyl-1,3-dioxane-4,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.