![(4E)-4-[(2-hydroxyethylamino)methylidene]-2-phenylisoquinoline-1,3-dione structure](/static/products/1164/1164522-21-7.webp)
(4E)-4-[(2-hydroxyethylamino)methylidene]-2-phenylisoquinoline-1,3-dione
TL;DR: (4E)-4-[(2-hydroxyethylamino)methylidene]-2-phenylisoquinoline-1,3-dione (CAS 1164522-21-7) is a chemical compound with molecular formula C18H16N2O3 and molecular weight 308.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-hydroxy-4-(2-hydroxyethyliminomethyl)-2-phenylisoquinolin-1-one
Also Known As: (4E)-4-[(2-hydroxyethylamino)methylidene]-2-phenylisoquinoline-1,3-dione, 4-[(2-hydroxyethylamino)methylidene]-2-phenylisoquinoline-1,3-dione, (4E)-4-[(2-hydroxyethylamino)methylene]-2-phenyl-isoquinoline-1,3-quinone, (4E)-4-[(2-hydroxyethylamino)methylidene]-2-phenyl-isoquinoline-1,3-dione, (4Z)-4-[(2-hydroxyethylamino)methylidene]-2-phenylisoquinoline-1,3-dione
| Molecular Formula | C18H16N2O3 |
|---|---|
| Molecular Weight | 308.12 g/mol |
| LogP | 2.1075 |
| Topological Polar Surface Area | 74.82 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 308.1161 |
| Heavy Atoms | 23 |
| Complexity | 914.6932 |
Chemical Identifiers
| CAS Number | 1164522-21-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=C(C3=CC=CC=C3C2=O)C=NCCO)O |
Product Overview
(4E)-4-[(2-hydroxyethylamino)methylidene]-2-phenylisoquinoline-1,3-dione (CAS 1164522-21-7), with molecular formula C18H16N2O3 and molecular weight 308.12 g/mol. IUPAC: 3-hydroxy-4-(2-hydroxyethyliminomethyl)-2-phenylisoquinolin-1-one.
Chemical Property Profile of (4E)-4-[(2-hydroxyethylamino)methylidene]-2-phenylisoquinoline-1,3-dione
Property Insights of (4E)-4-[(2-hydroxyethylamino)methylidene]-2-phenylisoquinoline-1,3-dione
The XLogP value of 2.1075 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4E)-4-[(2-hydroxyethylamino)methylidene]-2-phenylisoquinoline-1,3-dione. The TPSA of 74.82 Ų falls within the moderate polarity range, balancing permeability and solubility for (4E)-4-[(2-hydroxyethylamino)methylidene]-2-phenylisoquinoline-1,3-dione. Following Lipinski's Rule of Five, (4E)-4-[(2-hydroxyethylamino)methylidene]-2-phenylisoquinoline-1,3-dione has 2 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)-4-[(2-hydroxyethylamino)methylidene]-2-phenylisoquinoline-1,3-dione?
The CAS number of (4E)-4-[(2-hydroxyethylamino)methylidene]-2-phenylisoquinoline-1,3-dione is 1164522-21-7.
What is the molecular formula of (4E)-4-[(2-hydroxyethylamino)methylidene]-2-phenylisoquinoline-1,3-dione?
The molecular formula of (4E)-4-[(2-hydroxyethylamino)methylidene]-2-phenylisoquinoline-1,3-dione is C18H16N2O3.
What is the molecular weight of (4E)-4-[(2-hydroxyethylamino)methylidene]-2-phenylisoquinoline-1,3-dione?
The molecular weight of (4E)-4-[(2-hydroxyethylamino)methylidene]-2-phenylisoquinoline-1,3-dione is 308.12 g/mol.
Where can I buy (4E)-4-[(2-hydroxyethylamino)methylidene]-2-phenylisoquinoline-1,3-dione?
You can request a quote for (4E)-4-[(2-hydroxyethylamino)methylidene]-2-phenylisoquinoline-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)-4-[(2-hydroxyethylamino)methylidene]-2-phenylisoquinoline-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for (4E)-4-[(2-hydroxyethylamino)methylidene]-2-phenylisoquinoline-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.