![2-[(4-chlorobenzyl)oxy]-4-(4-toluidinomethylene)-1,3(2H,4H)-isoquinolinedione structure](/static/products/3384/338419-55-9.webp)
2-[(4-chlorobenzyl)oxy]-4-(4-toluidinomethylene)-1,3(2H,4H)-isoquinolinedione
TL;DR: 2-[(4-chlorobenzyl)oxy]-4-(4-toluidinomethylene)-1,3(2H,4H)-isoquinolinedione (CAS 338419-55-9) is a chemical compound with molecular formula C24H19ClN2O3 and molecular weight 418.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-chlorophenyl)methoxy]-3-hydroxy-4-[(4-methylphenyl)iminomethyl]isoquinolin-1-one
Also Known As: 4F-913, 2-[(4-chlorobenzyl)oxy]-4-(4-toluidinomethylene)-1,3(2H,4H)-isoquinolinedione, (4Z)-2-[(4-chlorophenyl)methoxy]-4-{[(4-methylphenyl)amino]methylidene}-1,2,3,4-tetrahydroisoquinoline-1,3-dione, 2-[(4-chlorophenyl)methoxy]-3-hydroxy-4-[(4-methylphenyl)iminomethyl]isoquinolin-1-one, (4Z)-2-[(4-chlorophenyl)methoxy]-4-[(4-methylanilino)methylidene]isoquinoline-1,3-dione
| Molecular Formula | C24H19ClN2O3 |
|---|---|
| Molecular Weight | 418.11 g/mol |
| LogP | 5.04832 |
| Topological Polar Surface Area | 63.82 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 418.10843 |
| Heavy Atoms | 30 |
| Complexity | 1277.0865 |
Chemical Identifiers
| CAS Number | 338419-55-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N=CC2=C(N(C(=O)C3=CC=CC=C32)OCC4=CC=C(C=C4)Cl)O |
Product Overview
2-[(4-chlorobenzyl)oxy]-4-(4-toluidinomethylene)-1,3(2H,4H)-isoquinolinedione (CAS 338419-55-9), with molecular formula C24H19ClN2O3 and molecular weight 418.11 g/mol. IUPAC: 2-[(4-chlorophenyl)methoxy]-3-hydroxy-4-[(4-methylphenyl)iminomethyl]isoquinolin-1-one.
Chemical Property Profile of 2-[(4-chlorobenzyl)oxy]-4-(4-toluidinomethylene)-1,3(2H,4H)-isoquinolinedione
Property Insights of 2-[(4-chlorobenzyl)oxy]-4-(4-toluidinomethylene)-1,3(2H,4H)-isoquinolinedione
The XLogP value of 5.04832 indicates that 2-[(4-chlorobenzyl)oxy]-4-(4-toluidinomethylene)-1,3(2H,4H)-isoquinolinedione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.82 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(4-chlorobenzyl)oxy]-4-(4-toluidinomethylene)-1,3(2H,4H)-isoquinolinedione. Following Lipinski's Rule of Five, 2-[(4-chlorobenzyl)oxy]-4-(4-toluidinomethylene)-1,3(2H,4H)-isoquinolinedione has 1 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 2-[(4-chlorobenzyl)oxy]-4-(4-toluidinomethylene)-1,3(2H,4H)-isoquinolinedione?
The CAS number of 2-[(4-chlorobenzyl)oxy]-4-(4-toluidinomethylene)-1,3(2H,4H)-isoquinolinedione is 338419-55-9.
What is the molecular formula of 2-[(4-chlorobenzyl)oxy]-4-(4-toluidinomethylene)-1,3(2H,4H)-isoquinolinedione?
The molecular formula of 2-[(4-chlorobenzyl)oxy]-4-(4-toluidinomethylene)-1,3(2H,4H)-isoquinolinedione is C24H19ClN2O3.
What is the molecular weight of 2-[(4-chlorobenzyl)oxy]-4-(4-toluidinomethylene)-1,3(2H,4H)-isoquinolinedione?
The molecular weight of 2-[(4-chlorobenzyl)oxy]-4-(4-toluidinomethylene)-1,3(2H,4H)-isoquinolinedione is 418.11 g/mol.
Where can I buy 2-[(4-chlorobenzyl)oxy]-4-(4-toluidinomethylene)-1,3(2H,4H)-isoquinolinedione?
You can request a quote for 2-[(4-chlorobenzyl)oxy]-4-(4-toluidinomethylene)-1,3(2H,4H)-isoquinolinedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(4-chlorobenzyl)oxy]-4-(4-toluidinomethylene)-1,3(2H,4H)-isoquinolinedione?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-chlorobenzyl)oxy]-4-(4-toluidinomethylene)-1,3(2H,4H)-isoquinolinedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.