(4E)-1-[2-(2-hydroxyethoxy)ethyl]-4-[hydroxy(4-nitrophenyl)methylidene]-5-(4-methylphenyl)pyrrolidine-2,3-dione
TL;DR: (4E)-1-[2-(2-hydroxyethoxy)ethyl]-4-[hydroxy(4-nitrophenyl)methylidene]-5-(4-methylphenyl)pyrrolidine-2,3-dione (CAS 517889-88-2) is a chemical compound with molecular formula C22H22N2O7 and molecular weight 426.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-1-[2-(2-hydroxyethoxy)ethyl]-4-[hydroxy-(4-nitrophenyl)methylidene]-5-(4-methylphenyl)pyrrolidine-2,3-dione
Also Known As: (4E)-1-[2-(2-hydroxyethoxy)ethyl]-4-[hydroxy(4-nitrophenyl)methylidene]-5-(4-methylphenyl)pyrrolidine-2,3-dione, (4E)-1-[2-(2-hydroxyethoxy)ethyl]-4-[hydroxy-(4-nitrophenyl)methylidene]-5-(4-methylphenyl)pyrrolidine-2,3-dione
| Molecular Formula | C22H22N2O7 |
|---|---|
| Molecular Weight | 426.14 g/mol |
| LogP | 2.33382 |
| Topological Polar Surface Area | 130.21 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 426.1427 |
| Heavy Atoms | 31 |
| Complexity | 1013.15985 |
Chemical Identifiers
| CAS Number | 517889-88-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2/C(=C(/C3=CC=C(C=C3)[N+](=O)[O-])\O)/C(=O)C(=O)N2CCOCCO |
Product Overview
(4E)-1-[2-(2-hydroxyethoxy)ethyl]-4-[hydroxy(4-nitrophenyl)methylidene]-5-(4-methylphenyl)pyrrolidine-2,3-dione (CAS 517889-88-2), with molecular formula C22H22N2O7 and molecular weight 426.14 g/mol. IUPAC: (4E)-1-[2-(2-hydroxyethoxy)ethyl]-4-[hydroxy-(4-nitrophenyl)methylidene]-5-(4-methylphenyl)pyrrolidine-2,3-dione.
Chemical Property Profile of (4E)-1-[2-(2-hydroxyethoxy)ethyl]-4-[hydroxy(4-nitrophenyl)methylidene]-5-(4-methylphenyl)pyrrolidine-2,3-dione
Property Insights of (4E)-1-[2-(2-hydroxyethoxy)ethyl]-4-[hydroxy(4-nitrophenyl)methylidene]-5-(4-methylphenyl)pyrrolidine-2,3-dione
The XLogP value of 2.33382 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4E)-1-[2-(2-hydroxyethoxy)ethyl]-4-[hydroxy(4-nitrophenyl)methylidene]-5-(4-methylphenyl)pyrrolidine-2,3-dione. The TPSA of 130.21 Ų falls within the moderate polarity range, balancing permeability and solubility for (4E)-1-[2-(2-hydroxyethoxy)ethyl]-4-[hydroxy(4-nitrophenyl)methylidene]-5-(4-methylphenyl)pyrrolidine-2,3-dione. Following Lipinski's Rule of Five, (4E)-1-[2-(2-hydroxyethoxy)ethyl]-4-[hydroxy(4-nitrophenyl)methylidene]-5-(4-methylphenyl)pyrrolidine-2,3-dione has 2 hydrogen bond donor(s) and 7 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)-1-[2-(2-hydroxyethoxy)ethyl]-4-[hydroxy(4-nitrophenyl)methylidene]-5-(4-methylphenyl)pyrrolidine-2,3-dione?
The CAS number of (4E)-1-[2-(2-hydroxyethoxy)ethyl]-4-[hydroxy(4-nitrophenyl)methylidene]-5-(4-methylphenyl)pyrrolidine-2,3-dione is 517889-88-2.
What is the molecular formula of (4E)-1-[2-(2-hydroxyethoxy)ethyl]-4-[hydroxy(4-nitrophenyl)methylidene]-5-(4-methylphenyl)pyrrolidine-2,3-dione?
The molecular formula of (4E)-1-[2-(2-hydroxyethoxy)ethyl]-4-[hydroxy(4-nitrophenyl)methylidene]-5-(4-methylphenyl)pyrrolidine-2,3-dione is C22H22N2O7.
What is the molecular weight of (4E)-1-[2-(2-hydroxyethoxy)ethyl]-4-[hydroxy(4-nitrophenyl)methylidene]-5-(4-methylphenyl)pyrrolidine-2,3-dione?
The molecular weight of (4E)-1-[2-(2-hydroxyethoxy)ethyl]-4-[hydroxy(4-nitrophenyl)methylidene]-5-(4-methylphenyl)pyrrolidine-2,3-dione is 426.14 g/mol.
Where can I buy (4E)-1-[2-(2-hydroxyethoxy)ethyl]-4-[hydroxy(4-nitrophenyl)methylidene]-5-(4-methylphenyl)pyrrolidine-2,3-dione?
You can request a quote for (4E)-1-[2-(2-hydroxyethoxy)ethyl]-4-[hydroxy(4-nitrophenyl)methylidene]-5-(4-methylphenyl)pyrrolidine-2,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4E)-1-[2-(2-hydroxyethoxy)ethyl]-4-[hydroxy(4-nitrophenyl)methylidene]-5-(4-methylphenyl)pyrrolidine-2,3-dione?
Yes, KEHONG BIO provides custom synthesis services for (4E)-1-[2-(2-hydroxyethoxy)ethyl]-4-[hydroxy(4-nitrophenyl)methylidene]-5-(4-methylphenyl)pyrrolidine-2,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.