![2-(3,4-dimethylphenyl)-4-[[(5-methylpyridin-2-yl)amino]methylidene]isoquinoline-1,3-dione structure](/static/products/729/729568-13-2.png)
2-(3,4-dimethylphenyl)-4-[[(5-methylpyridin-2-yl)amino]methylidene]isoquinoline-1,3-dione
TL;DR: 2-(3,4-dimethylphenyl)-4-[[(5-methylpyridin-2-yl)amino]methylidene]isoquinoline-1,3-dione (CAS 729568-13-2) is a chemical compound with molecular formula C24H21N3O2 and molecular weight 383.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dimethylphenyl)-3-hydroxy-4-[(5-methyl-2-pyridinyl)iminomethyl]isoquinolin-1-one
Also Known As: 2-(3,4-dimethylphenyl)-4-[[(5-methylpyridin-2-yl)amino]methylidene]isoquinoline-1,3-dione, (4E)-2-(3,4-dimethylphenyl)-4-[[(5-methylpyridin-2-yl)amino]methylidene]isoquinoline-1,3-dione, (4E)-2-(3,4-dimethylphenyl)-4-{[(5-methylpyridin-2-yl)amino]methylidene}isoquinoline-1,3(2H,4H)-dione, (4Z)-2-(3,4-dimethylphenyl)-4-[[(5-methylpyridin-2-yl)amino]methylidene]isoquinoline-1,3-dione, (E)-2-(3,4-dimethylphenyl)-4-(((5-methylpyridin-2-yl)amino)methylene)isoquinoline-1,3(2H,4H)-dione
| Molecular Formula | C24H21N3O2 |
|---|---|
| Molecular Weight | 383.16 g/mol |
| LogP | 4.76716 |
| Topological Polar Surface Area | 67.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 383.1634 |
| Heavy Atoms | 29 |
| Complexity | 1302.5043 |
Chemical Identifiers
| CAS Number | 729568-13-2 |
|---|---|
| SMILES | CC1=CN=C(C=C1)N=CC2=C(N(C(=O)C3=CC=CC=C32)C4=CC(=C(C=C4)C)C)O |
Product Overview
2-(3,4-dimethylphenyl)-4-[[(5-methylpyridin-2-yl)amino]methylidene]isoquinoline-1,3-dione (CAS 729568-13-2), with molecular formula C24H21N3O2 and molecular weight 383.16 g/mol. IUPAC: 2-(3,4-dimethylphenyl)-3-hydroxy-4-[(5-methyl-2-pyridinyl)iminomethyl]isoquinolin-1-one.
Chemical Property Profile of 2-(3,4-dimethylphenyl)-4-[[(5-methylpyridin-2-yl)amino]methylidene]isoquinoline-1,3-dione
Property Insights of 2-(3,4-dimethylphenyl)-4-[[(5-methylpyridin-2-yl)amino]methylidene]isoquinoline-1,3-dione
The XLogP value of 4.76716 indicates that 2-(3,4-dimethylphenyl)-4-[[(5-methylpyridin-2-yl)amino]methylidene]isoquinoline-1,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.48 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3,4-dimethylphenyl)-4-[[(5-methylpyridin-2-yl)amino]methylidene]isoquinoline-1,3-dione. Following Lipinski's Rule of Five, 2-(3,4-dimethylphenyl)-4-[[(5-methylpyridin-2-yl)amino]methylidene]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 2-(3,4-dimethylphenyl)-4-[[(5-methylpyridin-2-yl)amino]methylidene]isoquinoline-1,3-dione?
The CAS number of 2-(3,4-dimethylphenyl)-4-[[(5-methylpyridin-2-yl)amino]methylidene]isoquinoline-1,3-dione is 729568-13-2.
What is the molecular formula of 2-(3,4-dimethylphenyl)-4-[[(5-methylpyridin-2-yl)amino]methylidene]isoquinoline-1,3-dione?
The molecular formula of 2-(3,4-dimethylphenyl)-4-[[(5-methylpyridin-2-yl)amino]methylidene]isoquinoline-1,3-dione is C24H21N3O2.
What is the molecular weight of 2-(3,4-dimethylphenyl)-4-[[(5-methylpyridin-2-yl)amino]methylidene]isoquinoline-1,3-dione?
The molecular weight of 2-(3,4-dimethylphenyl)-4-[[(5-methylpyridin-2-yl)amino]methylidene]isoquinoline-1,3-dione is 383.16 g/mol.
Where can I buy 2-(3,4-dimethylphenyl)-4-[[(5-methylpyridin-2-yl)amino]methylidene]isoquinoline-1,3-dione?
You can request a quote for 2-(3,4-dimethylphenyl)-4-[[(5-methylpyridin-2-yl)amino]methylidene]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 2-(3,4-dimethylphenyl)-4-[[(5-methylpyridin-2-yl)amino]methylidene]isoquinoline-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,4-dimethylphenyl)-4-[[(5-methylpyridin-2-yl)amino]methylidene]isoquinoline-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.