![1-(6-hydroxy-4,7-dimethoxy-1-benzofuran-5-yl)-2-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)ethanone structure](/static/products/400/400772-69-2.png)
1-(6-hydroxy-4,7-dimethoxy-1-benzofuran-5-yl)-2-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)ethanone
TL;DR: 1-(6-hydroxy-4,7-dimethoxy-1-benzofuran-5-yl)-2-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)ethanone (CAS 400772-69-2) is a chemical compound with molecular formula C24H25NO8 and molecular weight 455.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(6-hydroxy-4,7-dimethoxy-1-benzofuran-5-yl)-2-(4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)ethanone
Also Known As: 1-(6-hydroxy-4,7-dimethoxy-1-benzofuran-5-yl)-2-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)ethanone, 1-(6-hydroxy-4,7-dimethoxy-1-benzofuran-5-yl)-2-(4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)ethanone, 1-(6-hydroxy-4,7-dimethoxybenzofuran-5-yl)-2-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)ethanone
| Molecular Formula | C24H25NO8 |
|---|---|
| Molecular Weight | 455.16 g/mol |
| LogP | 3.6949 |
| Topological Polar Surface Area | 99.83 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 455.15802 |
| Heavy Atoms | 33 |
| Complexity | 1247.4706 |
Chemical Identifiers
| CAS Number | 400772-69-2 |
|---|---|
| SMILES | CN1CCC2=CC3=C(C(=C2C1CC(=O)C4=C(C5=C(C(=C4O)OC)OC=C5)OC)OC)OCO3 |
Product Overview
1-(6-hydroxy-4,7-dimethoxy-1-benzofuran-5-yl)-2-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)ethanone (CAS 400772-69-2), with molecular formula C24H25NO8 and molecular weight 455.16 g/mol. IUPAC: 1-(6-hydroxy-4,7-dimethoxy-1-benzofuran-5-yl)-2-(4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)ethanone.
Chemical Property Profile of 1-(6-hydroxy-4,7-dimethoxy-1-benzofuran-5-yl)-2-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)ethanone
Property Insights of 1-(6-hydroxy-4,7-dimethoxy-1-benzofuran-5-yl)-2-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)ethanone
The XLogP value of 3.6949 indicates that 1-(6-hydroxy-4,7-dimethoxy-1-benzofuran-5-yl)-2-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(6-hydroxy-4,7-dimethoxy-1-benzofuran-5-yl)-2-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)ethanone. Following Lipinski's Rule of Five, 1-(6-hydroxy-4,7-dimethoxy-1-benzofuran-5-yl)-2-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)ethanone has 1 hydrogen bond donor(s) and 9 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 1-(6-hydroxy-4,7-dimethoxy-1-benzofuran-5-yl)-2-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)ethanone?
The CAS number of 1-(6-hydroxy-4,7-dimethoxy-1-benzofuran-5-yl)-2-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)ethanone is 400772-69-2.
What is the molecular formula of 1-(6-hydroxy-4,7-dimethoxy-1-benzofuran-5-yl)-2-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)ethanone?
The molecular formula of 1-(6-hydroxy-4,7-dimethoxy-1-benzofuran-5-yl)-2-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)ethanone is C24H25NO8.
What is the molecular weight of 1-(6-hydroxy-4,7-dimethoxy-1-benzofuran-5-yl)-2-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)ethanone?
The molecular weight of 1-(6-hydroxy-4,7-dimethoxy-1-benzofuran-5-yl)-2-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)ethanone is 455.16 g/mol.
Where can I buy 1-(6-hydroxy-4,7-dimethoxy-1-benzofuran-5-yl)-2-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)ethanone?
You can request a quote for 1-(6-hydroxy-4,7-dimethoxy-1-benzofuran-5-yl)-2-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(6-hydroxy-4,7-dimethoxy-1-benzofuran-5-yl)-2-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(6-hydroxy-4,7-dimethoxy-1-benzofuran-5-yl)-2-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.