(4Z)-2-(5-chloro-2-methoxyphenyl)-4-(methylaminomethylidene)isoquinoline-1,3-dione
TL;DR: (4Z)-2-(5-chloro-2-methoxyphenyl)-4-(methylaminomethylidene)isoquinoline-1,3-dione (CAS 892623-70-0) is a chemical compound with molecular formula C18H15ClN2O3 and molecular weight 342.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5-chloro-2-methoxyphenyl)-3-hydroxy-4-(methyliminomethyl)isoquinolin-1-one
Also Known As: (4Z)-2-(5-chloro-2-methoxyphenyl)-4-(methylaminomethylidene)isoquinoline-1,3-dione, (Z)-2-(5-chloro-2-methoxyphenyl)-4-((methylamino)methylene)isoquinoline-1,3(2H,4H)-dione, 2-(5-chloro-2-methoxy-phenyl)-4-(methylaminomethylidene)isoquinoline-1,3-dione, 2-(5-chloro-2-methoxyphenyl)-4-(methylaminomethylidene)isoquinoline-1,3-dione, (4Z)-2-(5-chloro-2-methoxyphenyl)-4-[(methylamino)methylidene]isoquinoline-1,3(2H,4H)-dione
| Molecular Formula | C18H15ClN2O3 |
|---|---|
| Molecular Weight | 342.08 g/mol |
| LogP | 3.407 |
| Topological Polar Surface Area | 63.82 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 342.07712 |
| Heavy Atoms | 24 |
| Complexity | 1009.0519 |
Chemical Identifiers
| CAS Number | 892623-70-0 |
|---|---|
| SMILES | CN=CC1=C(N(C(=O)C2=CC=CC=C21)C3=C(C=CC(=C3)Cl)OC)O |
Product Overview
(4Z)-2-(5-chloro-2-methoxyphenyl)-4-(methylaminomethylidene)isoquinoline-1,3-dione (CAS 892623-70-0), with molecular formula C18H15ClN2O3 and molecular weight 342.08 g/mol. IUPAC: 2-(5-chloro-2-methoxyphenyl)-3-hydroxy-4-(methyliminomethyl)isoquinolin-1-one.
Chemical Property Profile of (4Z)-2-(5-chloro-2-methoxyphenyl)-4-(methylaminomethylidene)isoquinoline-1,3-dione
Property Insights of (4Z)-2-(5-chloro-2-methoxyphenyl)-4-(methylaminomethylidene)isoquinoline-1,3-dione
The XLogP value of 3.407 indicates that (4Z)-2-(5-chloro-2-methoxyphenyl)-4-(methylaminomethylidene)isoquinoline-1,3-dione 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 (4Z)-2-(5-chloro-2-methoxyphenyl)-4-(methylaminomethylidene)isoquinoline-1,3-dione. Following Lipinski's Rule of Five, (4Z)-2-(5-chloro-2-methoxyphenyl)-4-(methylaminomethylidene)isoquinoline-1,3-dione has 1 hydrogen bond donor(s) and 4 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 (4Z)-2-(5-chloro-2-methoxyphenyl)-4-(methylaminomethylidene)isoquinoline-1,3-dione?
The CAS number of (4Z)-2-(5-chloro-2-methoxyphenyl)-4-(methylaminomethylidene)isoquinoline-1,3-dione is 892623-70-0.
What is the molecular formula of (4Z)-2-(5-chloro-2-methoxyphenyl)-4-(methylaminomethylidene)isoquinoline-1,3-dione?
The molecular formula of (4Z)-2-(5-chloro-2-methoxyphenyl)-4-(methylaminomethylidene)isoquinoline-1,3-dione is C18H15ClN2O3.
What is the molecular weight of (4Z)-2-(5-chloro-2-methoxyphenyl)-4-(methylaminomethylidene)isoquinoline-1,3-dione?
The molecular weight of (4Z)-2-(5-chloro-2-methoxyphenyl)-4-(methylaminomethylidene)isoquinoline-1,3-dione is 342.08 g/mol.
Where can I buy (4Z)-2-(5-chloro-2-methoxyphenyl)-4-(methylaminomethylidene)isoquinoline-1,3-dione?
You can request a quote for (4Z)-2-(5-chloro-2-methoxyphenyl)-4-(methylaminomethylidene)isoquinoline-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4Z)-2-(5-chloro-2-methoxyphenyl)-4-(methylaminomethylidene)isoquinoline-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for (4Z)-2-(5-chloro-2-methoxyphenyl)-4-(methylaminomethylidene)isoquinoline-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.