(Z)-(6,7-dimethoxyisoquinolin-1-yl)(3,4-dimethoxyphenyl)methanone O-nicotinoyl oxime
TL;DR: (Z)-(6,7-dimethoxyisoquinolin-1-yl)(3,4-dimethoxyphenyl)methanone O-nicotinoyl oxime (CAS 858745-89-8) is a chemical compound with molecular formula C26H23N3O6 and molecular weight 473.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(Z)-[(6,7-dimethoxyisoquinolin-1-yl)-(3,4-dimethoxyphenyl)methylidene]amino] pyridine-3-carboxylate
Also Known As: (Z)-(6,7-dimethoxyisoquinolin-1-yl)(3,4-dimethoxyphenyl)methanone O-nicotinoyl oxime, ({[(Z)-(6,7-dimethoxyisoquinolin-1-yl)(3,4-dimethoxyphenyl)methylidene]amino}oxy)(pyridin-3-yl)methanone, [(Z)-[(6,7-dimethoxyisoquinolin-1-yl)-(3,4-dimethoxyphenyl)methylidene]amino] pyridine-3-carboxylate, [[(6,7-dimethoxyisoquinolin-1-yl)-(3,4-dimethoxyphenyl)methylidene]amino] Pyridine-3-carboxylate
| Molecular Formula | C26H23N3O6 |
|---|---|
| Molecular Weight | 473.16 g/mol |
| LogP | 4.2736 |
| Topological Polar Surface Area | 101.36 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 473.1587 |
| Heavy Atoms | 35 |
| Complexity | 1388.9989 |
Chemical Identifiers
| CAS Number | 858745-89-8 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)/C(=N/OC(=O)C2=CN=CC=C2)/C3=NC=CC4=CC(=C(C=C43)OC)OC)OC |
Product Overview
(Z)-(6,7-dimethoxyisoquinolin-1-yl)(3,4-dimethoxyphenyl)methanone O-nicotinoyl oxime (CAS 858745-89-8), with molecular formula C26H23N3O6 and molecular weight 473.16 g/mol. IUPAC: [(Z)-[(6,7-dimethoxyisoquinolin-1-yl)-(3,4-dimethoxyphenyl)methylidene]amino] pyridine-3-carboxylate.
Chemical Property Profile of (Z)-(6,7-dimethoxyisoquinolin-1-yl)(3,4-dimethoxyphenyl)methanone O-nicotinoyl oxime
Property Insights of (Z)-(6,7-dimethoxyisoquinolin-1-yl)(3,4-dimethoxyphenyl)methanone O-nicotinoyl oxime
The XLogP value of 4.2736 indicates that (Z)-(6,7-dimethoxyisoquinolin-1-yl)(3,4-dimethoxyphenyl)methanone O-nicotinoyl oxime is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.36 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-(6,7-dimethoxyisoquinolin-1-yl)(3,4-dimethoxyphenyl)methanone O-nicotinoyl oxime. Following Lipinski's Rule of Five, (Z)-(6,7-dimethoxyisoquinolin-1-yl)(3,4-dimethoxyphenyl)methanone O-nicotinoyl oxime has 0 hydrogen bond donor(s) and 9 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 (Z)-(6,7-dimethoxyisoquinolin-1-yl)(3,4-dimethoxyphenyl)methanone O-nicotinoyl oxime?
The CAS number of (Z)-(6,7-dimethoxyisoquinolin-1-yl)(3,4-dimethoxyphenyl)methanone O-nicotinoyl oxime is 858745-89-8.
What is the molecular formula of (Z)-(6,7-dimethoxyisoquinolin-1-yl)(3,4-dimethoxyphenyl)methanone O-nicotinoyl oxime?
The molecular formula of (Z)-(6,7-dimethoxyisoquinolin-1-yl)(3,4-dimethoxyphenyl)methanone O-nicotinoyl oxime is C26H23N3O6.
What is the molecular weight of (Z)-(6,7-dimethoxyisoquinolin-1-yl)(3,4-dimethoxyphenyl)methanone O-nicotinoyl oxime?
The molecular weight of (Z)-(6,7-dimethoxyisoquinolin-1-yl)(3,4-dimethoxyphenyl)methanone O-nicotinoyl oxime is 473.16 g/mol.
Where can I buy (Z)-(6,7-dimethoxyisoquinolin-1-yl)(3,4-dimethoxyphenyl)methanone O-nicotinoyl oxime?
You can request a quote for (Z)-(6,7-dimethoxyisoquinolin-1-yl)(3,4-dimethoxyphenyl)methanone O-nicotinoyl oxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-(6,7-dimethoxyisoquinolin-1-yl)(3,4-dimethoxyphenyl)methanone O-nicotinoyl oxime?
Yes, KEHONG BIO provides custom synthesis services for (Z)-(6,7-dimethoxyisoquinolin-1-yl)(3,4-dimethoxyphenyl)methanone O-nicotinoyl oxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.