1-Benzyl-3-(4-ethoxyphenyl)-6,7-dimethoxyisoquinoline
TL;DR: 1-Benzyl-3-(4-ethoxyphenyl)-6,7-dimethoxyisoquinoline (CAS 376378-64-2) is a chemical compound with molecular formula C26H25NO3 and molecular weight 399.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-3-(4-ethoxyphenyl)-6,7-dimethoxyisoquinoline
Also Known As: ChemDiv1_021170, 1-benzyl-3-(4-ethoxyphenyl)-6,7-dimethoxyisoquinoline
| Molecular Formula | C26H25NO3 |
|---|---|
| Molecular Weight | 399.18 g/mol |
| LogP | 5.9085 |
| Topological Polar Surface Area | 40.58 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 399.18344 |
| Heavy Atoms | 30 |
| Complexity | 1138.4995 |
Chemical Identifiers
| CAS Number | 376378-64-2 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)C2=CC3=CC(=C(C=C3C(=N2)CC4=CC=CC=C4)OC)OC |
Product Overview
1-Benzyl-3-(4-ethoxyphenyl)-6,7-dimethoxyisoquinoline (CAS 376378-64-2), with molecular formula C26H25NO3 and molecular weight 399.18 g/mol. IUPAC: 1-benzyl-3-(4-ethoxyphenyl)-6,7-dimethoxyisoquinoline.
Chemical Property Profile of 1-Benzyl-3-(4-ethoxyphenyl)-6,7-dimethoxyisoquinoline
Property Insights of 1-Benzyl-3-(4-ethoxyphenyl)-6,7-dimethoxyisoquinoline
The XLogP value of 5.9085 indicates that 1-Benzyl-3-(4-ethoxyphenyl)-6,7-dimethoxyisoquinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.58 Ų, 1-Benzyl-3-(4-ethoxyphenyl)-6,7-dimethoxyisoquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Benzyl-3-(4-ethoxyphenyl)-6,7-dimethoxyisoquinoline has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Benzyl-3-(4-ethoxyphenyl)-6,7-dimethoxyisoquinoline?
The CAS number of 1-Benzyl-3-(4-ethoxyphenyl)-6,7-dimethoxyisoquinoline is 376378-64-2.
What is the molecular formula of 1-Benzyl-3-(4-ethoxyphenyl)-6,7-dimethoxyisoquinoline?
The molecular formula of 1-Benzyl-3-(4-ethoxyphenyl)-6,7-dimethoxyisoquinoline is C26H25NO3.
What is the molecular weight of 1-Benzyl-3-(4-ethoxyphenyl)-6,7-dimethoxyisoquinoline?
The molecular weight of 1-Benzyl-3-(4-ethoxyphenyl)-6,7-dimethoxyisoquinoline is 399.18 g/mol.
Where can I buy 1-Benzyl-3-(4-ethoxyphenyl)-6,7-dimethoxyisoquinoline?
You can request a quote for 1-Benzyl-3-(4-ethoxyphenyl)-6,7-dimethoxyisoquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzyl-3-(4-ethoxyphenyl)-6,7-dimethoxyisoquinoline?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzyl-3-(4-ethoxyphenyl)-6,7-dimethoxyisoquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.