![(4E)-1-[2-(2-hydroxyethoxy)ethyl]-5-(4-hydroxy-3-methoxyphenyl)-4-[hydroxy(3-nitrophenyl)methylidene]pyrrolidine-2,3-dione structure](/static/products/517/517890-40-3.png)
(4E)-1-[2-(2-hydroxyethoxy)ethyl]-5-(4-hydroxy-3-methoxyphenyl)-4-[hydroxy(3-nitrophenyl)methylidene]pyrrolidine-2,3-dione
TL;DR: (4E)-1-[2-(2-hydroxyethoxy)ethyl]-5-(4-hydroxy-3-methoxyphenyl)-4-[hydroxy(3-nitrophenyl)methylidene]pyrrolidine-2,3-dione (CAS 517890-40-3) is a chemical compound with molecular formula C22H22N2O9 and molecular weight 458.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-1-[2-(2-hydroxyethoxy)ethyl]-5-(4-hydroxy-3-methoxyphenyl)-4-[hydroxy-(3-nitrophenyl)methylidene]pyrrolidine-2,3-dione
Also Known As: (4E)-1-[2-(2-hydroxyethoxy)ethyl]-5-(4-hydroxy-3-methoxyphenyl)-4-[hydroxy(3-nitrophenyl)methylidene]pyrrolidine-2,3-dione, (4E)-1-[2-(2-hydroxyethoxy)ethyl]-5-(4-hydroxy-3-methoxyphenyl)-4-[hydroxy-(3-nitrophenyl)methylidene]pyrrolidine-2,3-dione
| Molecular Formula | C22H22N2O9 |
|---|---|
| Molecular Weight | 458.13 g/mol |
| LogP | 1.7396 |
| Topological Polar Surface Area | 159.67 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 458.13254 |
| Heavy Atoms | 33 |
| Complexity | 1112.7954 |
Chemical Identifiers
| CAS Number | 517890-40-3 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C2/C(=C(/C3=CC(=CC=C3)[N+](=O)[O-])\O)/C(=O)C(=O)N2CCOCCO)O |
Product Overview
(4E)-1-[2-(2-hydroxyethoxy)ethyl]-5-(4-hydroxy-3-methoxyphenyl)-4-[hydroxy(3-nitrophenyl)methylidene]pyrrolidine-2,3-dione (CAS 517890-40-3), with molecular formula C22H22N2O9 and molecular weight 458.13 g/mol. IUPAC: (4E)-1-[2-(2-hydroxyethoxy)ethyl]-5-(4-hydroxy-3-methoxyphenyl)-4-[hydroxy-(3-nitrophenyl)methylidene]pyrrolidine-2,3-dione.
Chemical Property Profile of (4E)-1-[2-(2-hydroxyethoxy)ethyl]-5-(4-hydroxy-3-methoxyphenyl)-4-[hydroxy(3-nitrophenyl)methylidene]pyrrolidine-2,3-dione
Property Insights of (4E)-1-[2-(2-hydroxyethoxy)ethyl]-5-(4-hydroxy-3-methoxyphenyl)-4-[hydroxy(3-nitrophenyl)methylidene]pyrrolidine-2,3-dione
The XLogP value of 1.7396 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4E)-1-[2-(2-hydroxyethoxy)ethyl]-5-(4-hydroxy-3-methoxyphenyl)-4-[hydroxy(3-nitrophenyl)methylidene]pyrrolidine-2,3-dione. The TPSA of 159.67 Ų indicates high polarity, suggesting (4E)-1-[2-(2-hydroxyethoxy)ethyl]-5-(4-hydroxy-3-methoxyphenyl)-4-[hydroxy(3-nitrophenyl)methylidene]pyrrolidine-2,3-dione may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (4E)-1-[2-(2-hydroxyethoxy)ethyl]-5-(4-hydroxy-3-methoxyphenyl)-4-[hydroxy(3-nitrophenyl)methylidene]pyrrolidine-2,3-dione has 3 hydrogen bond donor(s) and 9 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]-5-(4-hydroxy-3-methoxyphenyl)-4-[hydroxy(3-nitrophenyl)methylidene]pyrrolidine-2,3-dione?
The CAS number of (4E)-1-[2-(2-hydroxyethoxy)ethyl]-5-(4-hydroxy-3-methoxyphenyl)-4-[hydroxy(3-nitrophenyl)methylidene]pyrrolidine-2,3-dione is 517890-40-3.
What is the molecular formula of (4E)-1-[2-(2-hydroxyethoxy)ethyl]-5-(4-hydroxy-3-methoxyphenyl)-4-[hydroxy(3-nitrophenyl)methylidene]pyrrolidine-2,3-dione?
The molecular formula of (4E)-1-[2-(2-hydroxyethoxy)ethyl]-5-(4-hydroxy-3-methoxyphenyl)-4-[hydroxy(3-nitrophenyl)methylidene]pyrrolidine-2,3-dione is C22H22N2O9.
What is the molecular weight of (4E)-1-[2-(2-hydroxyethoxy)ethyl]-5-(4-hydroxy-3-methoxyphenyl)-4-[hydroxy(3-nitrophenyl)methylidene]pyrrolidine-2,3-dione?
The molecular weight of (4E)-1-[2-(2-hydroxyethoxy)ethyl]-5-(4-hydroxy-3-methoxyphenyl)-4-[hydroxy(3-nitrophenyl)methylidene]pyrrolidine-2,3-dione is 458.13 g/mol.
Where can I buy (4E)-1-[2-(2-hydroxyethoxy)ethyl]-5-(4-hydroxy-3-methoxyphenyl)-4-[hydroxy(3-nitrophenyl)methylidene]pyrrolidine-2,3-dione?
You can request a quote for (4E)-1-[2-(2-hydroxyethoxy)ethyl]-5-(4-hydroxy-3-methoxyphenyl)-4-[hydroxy(3-nitrophenyl)methylidene]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]-5-(4-hydroxy-3-methoxyphenyl)-4-[hydroxy(3-nitrophenyl)methylidene]pyrrolidine-2,3-dione?
Yes, KEHONG BIO provides custom synthesis services for (4E)-1-[2-(2-hydroxyethoxy)ethyl]-5-(4-hydroxy-3-methoxyphenyl)-4-[hydroxy(3-nitrophenyl)methylidene]pyrrolidine-2,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.