1,3-Dioxolo(4,5-g)isoquinoline, 4-methoxy-, hydrochloride
TL;DR: 1,3-Dioxolo(4,5-g)isoquinoline, 4-methoxy-, hydrochloride (CAS 5263-79-6) is a chemical compound with molecular formula C11H10ClNO3 and molecular weight 239.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxy-[1,3]dioxolo[4,5-g]isoquinolin-6-ium chloride
Also Known As: 4-Methoxy-1,3-dioxolo(4,5-g)isoquinoline hydrochloride, 4-methoxy-[1,3]dioxolo[4,5-g]isoquinolin-6-ium chloride, 1,3-DIOXOLO(4,5-g)ISOQUINOLINE, 4-METHOXY-, HYDROCHLORIDE, RefChem:219015
| Molecular Formula | C11H10ClNO3 |
|---|---|
| Molecular Weight | 239.03 g/mol |
| LogP | -1.6 |
| Topological Polar Surface Area | 41.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 239.03493 |
| Heavy Atoms | 16 |
| Complexity | 236.0 |
Chemical Identifiers
| CAS Number | 5263-79-6 |
|---|---|
| SMILES | COC1=C2C=[NH+]C=CC2=CC3=C1OCO3.[Cl-] |
| InChIKey | WSFKUKQTVZAWSS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-Dioxolo(4,5-g)isoquinoline, 4-methoxy-, hydrochloride (CAS 5263-79-6), with molecular formula C11H10ClNO3 and molecular weight 239.03 g/mol. IUPAC: 4-methoxy-[1,3]dioxolo[4,5-g]isoquinolin-6-ium chloride.
Chemical Property Profile of 1,3-Dioxolo(4,5-g)isoquinoline, 4-methoxy-, hydrochloride
Property Insights of 1,3-Dioxolo(4,5-g)isoquinoline, 4-methoxy-, hydrochloride
The XLogP value of -1.6 indicates that 1,3-Dioxolo(4,5-g)isoquinoline, 4-methoxy-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 41.8 Ų, 1,3-Dioxolo(4,5-g)isoquinoline, 4-methoxy-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dioxolo(4,5-g)isoquinoline, 4-methoxy-, hydrochloride has 1 hydrogen bond donor(s) and 4 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 1,3-Dioxolo(4,5-g)isoquinoline, 4-methoxy-, hydrochloride?
The CAS number of 1,3-Dioxolo(4,5-g)isoquinoline, 4-methoxy-, hydrochloride is 5263-79-6.
What is the molecular formula of 1,3-Dioxolo(4,5-g)isoquinoline, 4-methoxy-, hydrochloride?
The molecular formula of 1,3-Dioxolo(4,5-g)isoquinoline, 4-methoxy-, hydrochloride is C11H10ClNO3.
What is the molecular weight of 1,3-Dioxolo(4,5-g)isoquinoline, 4-methoxy-, hydrochloride?
The molecular weight of 1,3-Dioxolo(4,5-g)isoquinoline, 4-methoxy-, hydrochloride is 239.03 g/mol.
Where can I buy 1,3-Dioxolo(4,5-g)isoquinoline, 4-methoxy-, hydrochloride?
You can request a quote for 1,3-Dioxolo(4,5-g)isoquinoline, 4-methoxy-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dioxolo(4,5-g)isoquinoline, 4-methoxy-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dioxolo(4,5-g)isoquinoline, 4-methoxy-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.