4-(1,3-Benzodioxol-5-ylcarbonyl)-3-(3,4,5-trimethoxybenzyl)dihydrofuran-2(3H)-one
TL;DR: 4-(1,3-Benzodioxol-5-ylcarbonyl)-3-(3,4,5-trimethoxybenzyl)dihydrofuran-2(3H)-one (CAS 703-83-3) is a chemical compound with molecular formula C22H22O8 and molecular weight 414.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1,3-benzodioxole-5-carbonyl)-3-[(3,4,5-trimethoxyphenyl)methyl]oxolan-2-one
Also Known As: 4-(1,3-Benzodioxol-5-ylcarbonyl)-3-(3,4,5-trimethoxybenzyl)dihydrofuran-2(3H)-one, 4-(1,3-benzodioxole-5-carbonyl)-3-[(3,4,5-trimethoxyphenyl)m, 4-(1,3-benzodioxole-5-carbonyl)-3-[(3,4,5-trimethoxyphenyl)methyl]oxolan-2-one, 4-(Benzo[d][1,3]dioxole-5-carbonyl)-3-(3,4,5-trimethoxybenzyl)dihydrofuran-2(3H)-one, 4-(1,3-benzodioxole-5-carbonyl)-3-[(3,4,5-trimethoxyphenyl)methyl]tetrahydrofuran-2-one
| Molecular Formula | C22H22O8 |
|---|---|
| Molecular Weight | 414.13 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 89.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 414.13147 |
| Heavy Atoms | 30 |
| Complexity | 610.0 |
Chemical Identifiers
| CAS Number | 703-83-3 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)CC2C(COC2=O)C(=O)C3=CC4=C(C=C3)OCO4 |
| InChIKey | LJUBRCYIPBWVON-UHFFFAOYSA-N |
Product Overview
4-(1,3-Benzodioxol-5-ylcarbonyl)-3-(3,4,5-trimethoxybenzyl)dihydrofuran-2(3H)-one (CAS 703-83-3), with molecular formula C22H22O8 and molecular weight 414.13 g/mol. IUPAC: 4-(1,3-benzodioxole-5-carbonyl)-3-[(3,4,5-trimethoxyphenyl)methyl]oxolan-2-one.
Chemical Property Profile of 4-(1,3-Benzodioxol-5-ylcarbonyl)-3-(3,4,5-trimethoxybenzyl)dihydrofuran-2(3H)-one
Property Insights of 4-(1,3-Benzodioxol-5-ylcarbonyl)-3-(3,4,5-trimethoxybenzyl)dihydrofuran-2(3H)-one
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(1,3-Benzodioxol-5-ylcarbonyl)-3-(3,4,5-trimethoxybenzyl)dihydrofuran-2(3H)-one. The TPSA of 89.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(1,3-Benzodioxol-5-ylcarbonyl)-3-(3,4,5-trimethoxybenzyl)dihydrofuran-2(3H)-one. Following Lipinski's Rule of Five, 4-(1,3-Benzodioxol-5-ylcarbonyl)-3-(3,4,5-trimethoxybenzyl)dihydrofuran-2(3H)-one 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 4-(1,3-Benzodioxol-5-ylcarbonyl)-3-(3,4,5-trimethoxybenzyl)dihydrofuran-2(3H)-one?
The CAS number of 4-(1,3-Benzodioxol-5-ylcarbonyl)-3-(3,4,5-trimethoxybenzyl)dihydrofuran-2(3H)-one is 703-83-3.
What is the molecular formula of 4-(1,3-Benzodioxol-5-ylcarbonyl)-3-(3,4,5-trimethoxybenzyl)dihydrofuran-2(3H)-one?
The molecular formula of 4-(1,3-Benzodioxol-5-ylcarbonyl)-3-(3,4,5-trimethoxybenzyl)dihydrofuran-2(3H)-one is C22H22O8.
What is the molecular weight of 4-(1,3-Benzodioxol-5-ylcarbonyl)-3-(3,4,5-trimethoxybenzyl)dihydrofuran-2(3H)-one?
The molecular weight of 4-(1,3-Benzodioxol-5-ylcarbonyl)-3-(3,4,5-trimethoxybenzyl)dihydrofuran-2(3H)-one is 414.13 g/mol.
Where can I buy 4-(1,3-Benzodioxol-5-ylcarbonyl)-3-(3,4,5-trimethoxybenzyl)dihydrofuran-2(3H)-one?
You can request a quote for 4-(1,3-Benzodioxol-5-ylcarbonyl)-3-(3,4,5-trimethoxybenzyl)dihydrofuran-2(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(1,3-Benzodioxol-5-ylcarbonyl)-3-(3,4,5-trimethoxybenzyl)dihydrofuran-2(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 4-(1,3-Benzodioxol-5-ylcarbonyl)-3-(3,4,5-trimethoxybenzyl)dihydrofuran-2(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.