![[[(6,7-dimethoxyisoquinolin-1-yl)-(3,4-dimethoxyphenyl)methylidene]amino] 4-fluorobenzoate structure](/static/products/725/725692-33-1.png)
[[(6,7-dimethoxyisoquinolin-1-yl)-(3,4-dimethoxyphenyl)methylidene]amino] 4-fluorobenzoate
TL;DR: [[(6,7-dimethoxyisoquinolin-1-yl)-(3,4-dimethoxyphenyl)methylidene]amino] 4-fluorobenzoate (CAS 725692-33-1) is a chemical compound with molecular formula C27H23FN2O6 and molecular weight 490.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(E)-[(6,7-dimethoxyisoquinolin-1-yl)-(3,4-dimethoxyphenyl)methylidene]amino] 4-fluorobenzoate
Also Known As: [[(6,7-dimethoxyisoquinolin-1-yl)-(3,4-dimethoxyphenyl)methylidene]amino] 4-fluorobenzoate|({[(E)-(6,7-dimethoxyisoquinolin-1-yl)(3,4-dimethoxyphenyl)methylidene]amino}oxy)(4-fluorophenyl)methanone|(E)-(6,7-dimethoxyisoquinolin-1-yl)(3,4-dimethoxyphenyl)methanone O-(4-fluorobenzoyl) oxime|[(E)-[(6,7-dimethoxyisoquinolin-1-yl)-(3,4-dimethoxyphenyl)methylidene]amino] 4-fluorobenzoate
| Molecular Formula | C27H23FN2O6 |
|---|---|
| Molecular Weight | 490.15 g/mol |
| LogP | 5.0177 |
| Topological Polar Surface Area | 88.47 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 490.15402 |
| Heavy Atoms | 36 |
| Complexity | 1436.6559 |
Chemical Identifiers
| CAS Number | 725692-33-1 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)/C(=N\OC(=O)C2=CC=C(C=C2)F)/C3=NC=CC4=CC(=C(C=C43)OC)OC)OC |
Product Overview
[[(6,7-dimethoxyisoquinolin-1-yl)-(3,4-dimethoxyphenyl)methylidene]amino] 4-fluorobenzoate (CAS 725692-33-1), with molecular formula C27H23FN2O6 and molecular weight 490.15 g/mol. IUPAC: [(E)-[(6,7-dimethoxyisoquinolin-1-yl)-(3,4-dimethoxyphenyl)methylidene]amino] 4-fluorobenzoate.
Chemical Property Profile of [[(6,7-dimethoxyisoquinolin-1-yl)-(3,4-dimethoxyphenyl)methylidene]amino] 4-fluorobenzoate
Property Insights of [[(6,7-dimethoxyisoquinolin-1-yl)-(3,4-dimethoxyphenyl)methylidene]amino] 4-fluorobenzoate
The XLogP value of 5.0177 indicates that [[(6,7-dimethoxyisoquinolin-1-yl)-(3,4-dimethoxyphenyl)methylidene]amino] 4-fluorobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.47 Ų falls within the moderate polarity range, balancing permeability and solubility for [[(6,7-dimethoxyisoquinolin-1-yl)-(3,4-dimethoxyphenyl)methylidene]amino] 4-fluorobenzoate. Following Lipinski's Rule of Five, [[(6,7-dimethoxyisoquinolin-1-yl)-(3,4-dimethoxyphenyl)methylidene]amino] 4-fluorobenzoate has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of [[(6,7-dimethoxyisoquinolin-1-yl)-(3,4-dimethoxyphenyl)methylidene]amino] 4-fluorobenzoate?
The CAS number of [[(6,7-dimethoxyisoquinolin-1-yl)-(3,4-dimethoxyphenyl)methylidene]amino] 4-fluorobenzoate is 725692-33-1.
What is the molecular formula of [[(6,7-dimethoxyisoquinolin-1-yl)-(3,4-dimethoxyphenyl)methylidene]amino] 4-fluorobenzoate?
The molecular formula of [[(6,7-dimethoxyisoquinolin-1-yl)-(3,4-dimethoxyphenyl)methylidene]amino] 4-fluorobenzoate is C27H23FN2O6.
What is the molecular weight of [[(6,7-dimethoxyisoquinolin-1-yl)-(3,4-dimethoxyphenyl)methylidene]amino] 4-fluorobenzoate?
The molecular weight of [[(6,7-dimethoxyisoquinolin-1-yl)-(3,4-dimethoxyphenyl)methylidene]amino] 4-fluorobenzoate is 490.15 g/mol.
Where can I buy [[(6,7-dimethoxyisoquinolin-1-yl)-(3,4-dimethoxyphenyl)methylidene]amino] 4-fluorobenzoate?
You can request a quote for [[(6,7-dimethoxyisoquinolin-1-yl)-(3,4-dimethoxyphenyl)methylidene]amino] 4-fluorobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [[(6,7-dimethoxyisoquinolin-1-yl)-(3,4-dimethoxyphenyl)methylidene]amino] 4-fluorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for [[(6,7-dimethoxyisoquinolin-1-yl)-(3,4-dimethoxyphenyl)methylidene]amino] 4-fluorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.