4-(4-Chlorobenzyl)-6,7-dimethoxy-1-methylisoquinoline
TL;DR: 4-(4-Chlorobenzyl)-6,7-dimethoxy-1-methylisoquinoline (CAS 62334-25-2) is a chemical compound with molecular formula C19H18ClNO2 and molecular weight 327.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4-chlorophenyl)methyl]-6,7-dimethoxy-1-methylisoquinoline
Also Known As: 4-(4-chlorobenzyl)-6,7-dimethoxy-1-methylisoquinoline, 4-[(4-chlorophenyl)methyl]-6,7-dimethoxy-1-methylisoquinoline, 1-Methyl-4-(4-chlorobenzyl)-6,7-dimethoxyisoquinoline, Isoquinoline, 4-[(4-chlorophenyl)methyl]-6,7-dimethoxy-1-methyl-, 4-[(4-chlorophenyl)methyl]-6,7-dimethoxy-1-methyl-isoquinoline
| Molecular Formula | C19H18ClNO2 |
|---|---|
| Molecular Weight | 327.10 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 31.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 327.1026 |
| Heavy Atoms | 23 |
| Complexity | 372.0 |
Chemical Identifiers
| CAS Number | 62334-25-2 |
|---|---|
| SMILES | CC1=NC=C(C2=CC(=C(C=C12)OC)OC)CC3=CC=C(C=C3)Cl |
| InChIKey | XXFOFFZVPWDNMJ-UHFFFAOYSA-N |
Product Overview
4-(4-Chlorobenzyl)-6,7-dimethoxy-1-methylisoquinoline (CAS 62334-25-2), with molecular formula C19H18ClNO2 and molecular weight 327.10 g/mol. IUPAC: 4-[(4-chlorophenyl)methyl]-6,7-dimethoxy-1-methylisoquinoline.
Chemical Property Profile of 4-(4-Chlorobenzyl)-6,7-dimethoxy-1-methylisoquinoline
Property Insights of 4-(4-Chlorobenzyl)-6,7-dimethoxy-1-methylisoquinoline
The XLogP value of 5.0 indicates that 4-(4-Chlorobenzyl)-6,7-dimethoxy-1-methylisoquinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 31.4 Ų, 4-(4-Chlorobenzyl)-6,7-dimethoxy-1-methylisoquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-Chlorobenzyl)-6,7-dimethoxy-1-methylisoquinoline 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 4-(4-Chlorobenzyl)-6,7-dimethoxy-1-methylisoquinoline?
The CAS number of 4-(4-Chlorobenzyl)-6,7-dimethoxy-1-methylisoquinoline is 62334-25-2.
What is the molecular formula of 4-(4-Chlorobenzyl)-6,7-dimethoxy-1-methylisoquinoline?
The molecular formula of 4-(4-Chlorobenzyl)-6,7-dimethoxy-1-methylisoquinoline is C19H18ClNO2.
What is the molecular weight of 4-(4-Chlorobenzyl)-6,7-dimethoxy-1-methylisoquinoline?
The molecular weight of 4-(4-Chlorobenzyl)-6,7-dimethoxy-1-methylisoquinoline is 327.10 g/mol.
Where can I buy 4-(4-Chlorobenzyl)-6,7-dimethoxy-1-methylisoquinoline?
You can request a quote for 4-(4-Chlorobenzyl)-6,7-dimethoxy-1-methylisoquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-Chlorobenzyl)-6,7-dimethoxy-1-methylisoquinoline?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Chlorobenzyl)-6,7-dimethoxy-1-methylisoquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.