Methanone, (4-methoxyphenyl)(5,6,7-trimethoxy-1-isoquinolinyl)-
TL;DR: Methanone, (4-methoxyphenyl)(5,6,7-trimethoxy-1-isoquinolinyl)- (CAS 84716-73-4) is a chemical compound with molecular formula C20H19NO5 and molecular weight 353.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-methoxyphenyl)-(5,6,7-trimethoxyisoquinolin-1-yl)methanone
Also Known As: Thalimicrinone, Methanone, (4-methoxyphenyl)(5,6,7-trimethoxy-1-isoquinolinyl)-, 1-(4-Methoxybenzoyl)-5,6,7-trimethoxyisoquinoline, 5,6,7-Trimethoxy-1-(4-methoxybenzoyl)isoquinoline, (4-methoxyphenyl)-(5,6,7-trimethoxyisoquinolin-1-yl)methanone
| Molecular Formula | C20H19NO5 |
|---|---|
| Molecular Weight | 353.13 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 66.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 353.1263 |
| Heavy Atoms | 26 |
| Complexity | 465.0 |
Chemical Identifiers
| CAS Number | 84716-73-4 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(=O)C2=NC=CC3=C(C(=C(C=C32)OC)OC)OC |
| InChIKey | XQBHRWCIOAUHCK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methanone, (4-methoxyphenyl)(5,6,7-trimethoxy-1-isoquinolinyl)- (CAS 84716-73-4), with molecular formula C20H19NO5 and molecular weight 353.13 g/mol. IUPAC: (4-methoxyphenyl)-(5,6,7-trimethoxyisoquinolin-1-yl)methanone.
Chemical Property Profile of Methanone, (4-methoxyphenyl)(5,6,7-trimethoxy-1-isoquinolinyl)-
Property Insights of Methanone, (4-methoxyphenyl)(5,6,7-trimethoxy-1-isoquinolinyl)-
The XLogP value of 3.7 indicates that Methanone, (4-methoxyphenyl)(5,6,7-trimethoxy-1-isoquinolinyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Methanone, (4-methoxyphenyl)(5,6,7-trimethoxy-1-isoquinolinyl)-. Following Lipinski's Rule of Five, Methanone, (4-methoxyphenyl)(5,6,7-trimethoxy-1-isoquinolinyl)- has 0 hydrogen bond donor(s) and 6 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 Methanone, (4-methoxyphenyl)(5,6,7-trimethoxy-1-isoquinolinyl)-?
The CAS number of Methanone, (4-methoxyphenyl)(5,6,7-trimethoxy-1-isoquinolinyl)- is 84716-73-4.
What is the molecular formula of Methanone, (4-methoxyphenyl)(5,6,7-trimethoxy-1-isoquinolinyl)-?
The molecular formula of Methanone, (4-methoxyphenyl)(5,6,7-trimethoxy-1-isoquinolinyl)- is C20H19NO5.
What is the molecular weight of Methanone, (4-methoxyphenyl)(5,6,7-trimethoxy-1-isoquinolinyl)-?
The molecular weight of Methanone, (4-methoxyphenyl)(5,6,7-trimethoxy-1-isoquinolinyl)- is 353.13 g/mol.
Where can I buy Methanone, (4-methoxyphenyl)(5,6,7-trimethoxy-1-isoquinolinyl)-?
You can request a quote for Methanone, (4-methoxyphenyl)(5,6,7-trimethoxy-1-isoquinolinyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methanone, (4-methoxyphenyl)(5,6,7-trimethoxy-1-isoquinolinyl)-?
Yes, KEHONG BIO provides custom synthesis services for Methanone, (4-methoxyphenyl)(5,6,7-trimethoxy-1-isoquinolinyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.