![[(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]acetic acid structure](/static/products/489/489464-76-8.png)
[(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]acetic acid
TL;DR: [(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]acetic acid (CAS 489464-76-8) is a chemical compound with molecular formula C19H13N3O9 and molecular weight 427.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3E)-3-[hydroxy-(4-nitrophenyl)methylidene]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]acetic acid
Also Known As: [(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]acetic acid|2-(3-hydroxy-4-(4-nitrobenzoyl)-5-(4-nitrophenyl)-2-oxo-2,5-dihydro-1H-pyrrol-1-yl)acetic acid|2-[(3E)-3-[hydroxy-(4-nitrophenyl)methylidene]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]acetic acid|2-[3-[hydroxy-(4-nitrophenyl)methylidene]-2-(4-nitrophenyl)-4,5-dioxo-pyrrolidin-1-yl]acetic Acid
| Molecular Formula | C19H13N3O9 |
|---|---|
| Molecular Weight | 427.07 g/mol |
| LogP | 2.0093 |
| Topological Polar Surface Area | 181.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 427.0652 |
| Heavy Atoms | 31 |
| Complexity | 1137.2185 |
Chemical Identifiers
| CAS Number | 489464-76-8 |
|---|---|
| SMILES | C1=CC(=CC=C1C2/C(=C(/C3=CC=C(C=C3)[N+](=O)[O-])\O)/C(=O)C(=O)N2CC(=O)O)[N+](=O)[O-] |
Product Overview
[(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]acetic acid (CAS 489464-76-8), with molecular formula C19H13N3O9 and molecular weight 427.07 g/mol. IUPAC: 2-[(3E)-3-[hydroxy-(4-nitrophenyl)methylidene]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]acetic acid.
Chemical Property Profile of [(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]acetic acid
Property Insights of [(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]acetic acid
The XLogP value of 2.0093 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]acetic acid. The TPSA of 181.19 Ų indicates high polarity, suggesting [(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]acetic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, [(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]acetic acid has 2 hydrogen bond donor(s) and 8 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 [(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]acetic acid?
The CAS number of [(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]acetic acid is 489464-76-8.
What is the molecular formula of [(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]acetic acid?
The molecular formula of [(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]acetic acid is C19H13N3O9.
What is the molecular weight of [(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]acetic acid?
The molecular weight of [(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]acetic acid is 427.07 g/mol.
Where can I buy [(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]acetic acid?
You can request a quote for [(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]acetic acid?
Yes, KEHONG BIO provides custom synthesis services for [(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.