![(2E)-2-[[(4-hydroxy-9,10-dioxoanthracen-1-yl)amino]methylidene]-4,4-dimethyl-3-oxopentanenitrile structure](/static/products/102/1025124-22-4.png)
(2E)-2-[[(4-hydroxy-9,10-dioxoanthracen-1-yl)amino]methylidene]-4,4-dimethyl-3-oxopentanenitrile
TL;DR: (2E)-2-[[(4-hydroxy-9,10-dioxoanthracen-1-yl)amino]methylidene]-4,4-dimethyl-3-oxopentanenitrile (CAS 1025124-22-4) is a chemical compound with molecular formula C22H18N2O4 and molecular weight 374.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E)-2-[[(4-hydroxy-9,10-dioxoanthracen-1-yl)amino]methylidene]-4,4-dimethyl-3-oxopentanenitrile
Also Known As: (2E)-2-[[(4-hydroxy-9,10-dioxoanthracen-1-yl)amino]methylidene]-4,4-dimethyl-3-oxopentanenitrile, 2-(2,2-DIMETHYLPROPANOYL)-3-((4-HYDROXY-9,10-DIOXOANTHRYL)AMINO)PROP-2-ENENITRILE, (2E)-2-[[(4-hydroxy-9,10-dioxo-1-anthryl)amino]methylene]-4,4-dimethyl-3-oxo-pentanenitrile, 2-[[(4-hydroxy-9,10-dioxo-anthracen-1-yl)amino]methylidene]-4,4-dimethyl-3-oxo-pentanenitrile, 2-[[(4-hydroxy-9,10-dioxoanthracen-1-yl)amino]methylidene]-4,4-dimethyl-3-oxopentanenitrile
| Molecular Formula | C22H18N2O4 |
|---|---|
| Molecular Weight | 374.13 g/mol |
| LogP | 3.60218 |
| Topological Polar Surface Area | 107.26 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 374.12665 |
| Heavy Atoms | 28 |
| Complexity | 1098.4955 |
Chemical Identifiers
| CAS Number | 1025124-22-4 |
|---|---|
| SMILES | CC(C)(C)C(=O)/C(=C/NC1=C2C(=C(C=C1)O)C(=O)C3=CC=CC=C3C2=O)/C#N |
Product Overview
(2E)-2-[[(4-hydroxy-9,10-dioxoanthracen-1-yl)amino]methylidene]-4,4-dimethyl-3-oxopentanenitrile (CAS 1025124-22-4), with molecular formula C22H18N2O4 and molecular weight 374.13 g/mol. IUPAC: (2E)-2-[[(4-hydroxy-9,10-dioxoanthracen-1-yl)amino]methylidene]-4,4-dimethyl-3-oxopentanenitrile.
Chemical Property Profile of (2E)-2-[[(4-hydroxy-9,10-dioxoanthracen-1-yl)amino]methylidene]-4,4-dimethyl-3-oxopentanenitrile
Property Insights of (2E)-2-[[(4-hydroxy-9,10-dioxoanthracen-1-yl)amino]methylidene]-4,4-dimethyl-3-oxopentanenitrile
The XLogP value of 3.60218 indicates that (2E)-2-[[(4-hydroxy-9,10-dioxoanthracen-1-yl)amino]methylidene]-4,4-dimethyl-3-oxopentanenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.26 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-2-[[(4-hydroxy-9,10-dioxoanthracen-1-yl)amino]methylidene]-4,4-dimethyl-3-oxopentanenitrile. Following Lipinski's Rule of Five, (2E)-2-[[(4-hydroxy-9,10-dioxoanthracen-1-yl)amino]methylidene]-4,4-dimethyl-3-oxopentanenitrile has 2 hydrogen bond donor(s) and 6 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 (2E)-2-[[(4-hydroxy-9,10-dioxoanthracen-1-yl)amino]methylidene]-4,4-dimethyl-3-oxopentanenitrile?
The CAS number of (2E)-2-[[(4-hydroxy-9,10-dioxoanthracen-1-yl)amino]methylidene]-4,4-dimethyl-3-oxopentanenitrile is 1025124-22-4.
What is the molecular formula of (2E)-2-[[(4-hydroxy-9,10-dioxoanthracen-1-yl)amino]methylidene]-4,4-dimethyl-3-oxopentanenitrile?
The molecular formula of (2E)-2-[[(4-hydroxy-9,10-dioxoanthracen-1-yl)amino]methylidene]-4,4-dimethyl-3-oxopentanenitrile is C22H18N2O4.
What is the molecular weight of (2E)-2-[[(4-hydroxy-9,10-dioxoanthracen-1-yl)amino]methylidene]-4,4-dimethyl-3-oxopentanenitrile?
The molecular weight of (2E)-2-[[(4-hydroxy-9,10-dioxoanthracen-1-yl)amino]methylidene]-4,4-dimethyl-3-oxopentanenitrile is 374.13 g/mol.
Where can I buy (2E)-2-[[(4-hydroxy-9,10-dioxoanthracen-1-yl)amino]methylidene]-4,4-dimethyl-3-oxopentanenitrile?
You can request a quote for (2E)-2-[[(4-hydroxy-9,10-dioxoanthracen-1-yl)amino]methylidene]-4,4-dimethyl-3-oxopentanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-2-[[(4-hydroxy-9,10-dioxoanthracen-1-yl)amino]methylidene]-4,4-dimethyl-3-oxopentanenitrile?
Yes, KEHONG BIO provides custom synthesis services for (2E)-2-[[(4-hydroxy-9,10-dioxoanthracen-1-yl)amino]methylidene]-4,4-dimethyl-3-oxopentanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.