(4E)-2-(4-methylphenyl)-4-[(pyridin-2-ylmethylamino)methylidene]isoquinoline-1,3-dione
TL;DR: (4E)-2-(4-methylphenyl)-4-[(pyridin-2-ylmethylamino)methylidene]isoquinoline-1,3-dione (CAS 1164451-83-5) is a chemical compound with molecular formula C23H19N3O2 and molecular weight 369.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-hydroxy-2-(4-methylphenyl)-4-(pyridin-2-ylmethyliminomethyl)isoquinolin-1-one
Also Known As: (4E)-2-(4-methylphenyl)-4-[(pyridin-2-ylmethylamino)methylidene]isoquinoline-1,3-dione, (E)-4-(((pyridin-2-ylmethyl)amino)methylene)-2-(p-tolyl)isoquinoline-1,3(2H,4H)-dione, 2-(4-methylphenyl)-4-[(pyridin-2-ylmethylamino)methylidene]isoquinoline-1,3-dione, 4-[1-[(Pyridin-2-ylmethyl)-amino]-meth-(E)-ylidene]-2-p-tolyl-4H-isoquinoline-1,3-dione, (4E)-2-(4-methylphenyl)-4-{[(pyridin-2-ylmethyl)amino]methylidene}isoquinoline-1,3(2H,4H)-dione
| Molecular Formula | C23H19N3O2 |
|---|---|
| Molecular Weight | 369.15 g/mol |
| LogP | 4.01882 |
| Topological Polar Surface Area | 67.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 369.14774 |
| Heavy Atoms | 28 |
| Complexity | 1210.5319 |
Chemical Identifiers
| CAS Number | 1164451-83-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=C(C3=CC=CC=C3C2=O)C=NCC4=CC=CC=N4)O |
Product Overview
(4E)-2-(4-methylphenyl)-4-[(pyridin-2-ylmethylamino)methylidene]isoquinoline-1,3-dione (CAS 1164451-83-5), with molecular formula C23H19N3O2 and molecular weight 369.15 g/mol. IUPAC: 3-hydroxy-2-(4-methylphenyl)-4-(pyridin-2-ylmethyliminomethyl)isoquinolin-1-one.
Chemical Property Profile of (4E)-2-(4-methylphenyl)-4-[(pyridin-2-ylmethylamino)methylidene]isoquinoline-1,3-dione
Property Insights of (4E)-2-(4-methylphenyl)-4-[(pyridin-2-ylmethylamino)methylidene]isoquinoline-1,3-dione
The XLogP value of 4.01882 indicates that (4E)-2-(4-methylphenyl)-4-[(pyridin-2-ylmethylamino)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 (4E)-2-(4-methylphenyl)-4-[(pyridin-2-ylmethylamino)methylidene]isoquinoline-1,3-dione. Following Lipinski's Rule of Five, (4E)-2-(4-methylphenyl)-4-[(pyridin-2-ylmethylamino)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 (4E)-2-(4-methylphenyl)-4-[(pyridin-2-ylmethylamino)methylidene]isoquinoline-1,3-dione?
The CAS number of (4E)-2-(4-methylphenyl)-4-[(pyridin-2-ylmethylamino)methylidene]isoquinoline-1,3-dione is 1164451-83-5.
What is the molecular formula of (4E)-2-(4-methylphenyl)-4-[(pyridin-2-ylmethylamino)methylidene]isoquinoline-1,3-dione?
The molecular formula of (4E)-2-(4-methylphenyl)-4-[(pyridin-2-ylmethylamino)methylidene]isoquinoline-1,3-dione is C23H19N3O2.
What is the molecular weight of (4E)-2-(4-methylphenyl)-4-[(pyridin-2-ylmethylamino)methylidene]isoquinoline-1,3-dione?
The molecular weight of (4E)-2-(4-methylphenyl)-4-[(pyridin-2-ylmethylamino)methylidene]isoquinoline-1,3-dione is 369.15 g/mol.
Where can I buy (4E)-2-(4-methylphenyl)-4-[(pyridin-2-ylmethylamino)methylidene]isoquinoline-1,3-dione?
You can request a quote for (4E)-2-(4-methylphenyl)-4-[(pyridin-2-ylmethylamino)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 (4E)-2-(4-methylphenyl)-4-[(pyridin-2-ylmethylamino)methylidene]isoquinoline-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for (4E)-2-(4-methylphenyl)-4-[(pyridin-2-ylmethylamino)methylidene]isoquinoline-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.