![5-Methyl-[1,3]dioxolo[4,5-g]isoquinoline structure](/static/products/6787/67879-24-7.webp)
5-Methyl-[1,3]dioxolo[4,5-g]isoquinoline
TL;DR: 5-Methyl-[1,3]dioxolo[4,5-g]isoquinoline (CAS 67879-24-7) is a chemical compound with molecular formula C11H9NO2 and molecular weight 187.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-[1,3]dioxolo[4,5-g]isoquinoline
Also Known As: 5-methyl-[1,3]dioxolo[4,5-g]isoquinoline, 5-methyl-2H-[1,3]dioxolo[4,5-g]isoquinoline
| Molecular Formula | C11H9NO2 |
|---|---|
| Molecular Weight | 187.06 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 31.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 187.06332 |
| Heavy Atoms | 14 |
| Complexity | 221.0 |
Chemical Identifiers
| CAS Number | 67879-24-7 |
|---|---|
| SMILES | CC1=NC=CC2=CC3=C(C=C12)OCO3 |
| InChIKey | GFHYLSDPSSIEGC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Methyl-[1,3]dioxolo[4,5-g]isoquinoline (CAS 67879-24-7), with molecular formula C11H9NO2 and molecular weight 187.06 g/mol. IUPAC: 5-methyl-[1,3]dioxolo[4,5-g]isoquinoline.
Chemical Property Profile of 5-Methyl-[1,3]dioxolo[4,5-g]isoquinoline
Property Insights of 5-Methyl-[1,3]dioxolo[4,5-g]isoquinoline
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Methyl-[1,3]dioxolo[4,5-g]isoquinoline. With a topological polar surface area (TPSA) of 31.4 Ų, 5-Methyl-[1,3]dioxolo[4,5-g]isoquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Methyl-[1,3]dioxolo[4,5-g]isoquinoline has 0 hydrogen bond donor(s) and 3 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-Methyl-[1,3]dioxolo[4,5-g]isoquinoline?
The CAS number of 5-Methyl-[1,3]dioxolo[4,5-g]isoquinoline is 67879-24-7.
What is the molecular formula of 5-Methyl-[1,3]dioxolo[4,5-g]isoquinoline?
The molecular formula of 5-Methyl-[1,3]dioxolo[4,5-g]isoquinoline is C11H9NO2.
What is the molecular weight of 5-Methyl-[1,3]dioxolo[4,5-g]isoquinoline?
The molecular weight of 5-Methyl-[1,3]dioxolo[4,5-g]isoquinoline is 187.06 g/mol.
Where can I buy 5-Methyl-[1,3]dioxolo[4,5-g]isoquinoline?
You can request a quote for 5-Methyl-[1,3]dioxolo[4,5-g]isoquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Methyl-[1,3]dioxolo[4,5-g]isoquinoline?
Yes, KEHONG BIO provides custom synthesis services for 5-Methyl-[1,3]dioxolo[4,5-g]isoquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.