![3-(7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-3-hydroxy-6,7-dimethoxy-2-benzofuran-1-one structure](/static/products/6639/66392-99-2.webp)
3-(7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-3-hydroxy-6,7-dimethoxy-2-benzofuran-1-one
TL;DR: 3-(7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-3-hydroxy-6,7-dimethoxy-2-benzofuran-1-one (CAS 66392-99-2) is a chemical compound with molecular formula C20H17NO7 and molecular weight 383.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-3-hydroxy-6,7-dimethoxy-2-benzofuran-1-one
Also Known As: 3-(7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-3-hydroxy-6,7-dimethoxy-2-benzofuran-1-one, 3-(7,8-Dihydro-2H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-3-hydroxy-6,7-dimethoxy-2-benzofuran-1(3H)-one
| Molecular Formula | C20H17NO7 |
|---|---|
| Molecular Weight | 383.10 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 95.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 383.1005 |
| Heavy Atoms | 28 |
| Complexity | 669.0 |
Chemical Identifiers
| CAS Number | 66392-99-2 |
|---|---|
| SMILES | COC1=C(C2=C(C=C1)C(OC2=O)(C3=NCCC4=CC5=C(C=C43)OCO5)O)OC |
| InChIKey | IJYTUTLJLCRPOV-UHFFFAOYSA-N |
Product Overview
3-(7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-3-hydroxy-6,7-dimethoxy-2-benzofuran-1-one (CAS 66392-99-2), with molecular formula C20H17NO7 and molecular weight 383.10 g/mol. IUPAC: 3-(7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-3-hydroxy-6,7-dimethoxy-2-benzofuran-1-one.
Chemical Property Profile of 3-(7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-3-hydroxy-6,7-dimethoxy-2-benzofuran-1-one
Property Insights of 3-(7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-3-hydroxy-6,7-dimethoxy-2-benzofuran-1-one
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-3-hydroxy-6,7-dimethoxy-2-benzofuran-1-one. The TPSA of 95.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-3-hydroxy-6,7-dimethoxy-2-benzofuran-1-one. Following Lipinski's Rule of Five, 3-(7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-3-hydroxy-6,7-dimethoxy-2-benzofuran-1-one has 1 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 3-(7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-3-hydroxy-6,7-dimethoxy-2-benzofuran-1-one?
The CAS number of 3-(7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-3-hydroxy-6,7-dimethoxy-2-benzofuran-1-one is 66392-99-2.
What is the molecular formula of 3-(7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-3-hydroxy-6,7-dimethoxy-2-benzofuran-1-one?
The molecular formula of 3-(7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-3-hydroxy-6,7-dimethoxy-2-benzofuran-1-one is C20H17NO7.
What is the molecular weight of 3-(7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-3-hydroxy-6,7-dimethoxy-2-benzofuran-1-one?
The molecular weight of 3-(7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-3-hydroxy-6,7-dimethoxy-2-benzofuran-1-one is 383.10 g/mol.
Where can I buy 3-(7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-3-hydroxy-6,7-dimethoxy-2-benzofuran-1-one?
You can request a quote for 3-(7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-3-hydroxy-6,7-dimethoxy-2-benzofuran-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-3-hydroxy-6,7-dimethoxy-2-benzofuran-1-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-3-hydroxy-6,7-dimethoxy-2-benzofuran-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.