{(3E)-2-(2-fluorophenyl)-3-[hydroxy(4-nitrophenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}acetic acid
TL;DR: {(3E)-2-(2-fluorophenyl)-3-[hydroxy(4-nitrophenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}acetic acid (CAS 488744-24-7) is a chemical compound with molecular formula C19H13FN2O7 and molecular weight 400.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3E)-2-(2-fluorophenyl)-3-[hydroxy-(4-nitrophenyl)methylidene]-4,5-dioxopyrrolidin-1-yl]acetic acid
Also Known As: {(3E)-2-(2-fluorophenyl)-3-[hydroxy(4-nitrophenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}acetic acid, 2-(2-(2-fluorophenyl)-4-hydroxy-3-(4-nitrobenzoyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl)acetic acid, 2-[(3E)-2-(2-fluorophenyl)-3-[hydroxy-(4-nitrophenyl)methylidene]-4,5-dioxopyrrolidin-1-yl]acetic acid, 2-[2-(2-fluorophenyl)-3-[hydroxy-(4-nitrophenyl)methylidene]-4,5-dioxo-pyrrolidin-1-yl]acetic Acid
| Molecular Formula | C19H13FN2O7 |
|---|---|
| Molecular Weight | 400.07 g/mol |
| LogP | 2.2402 |
| Topological Polar Surface Area | 138.05 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 400.07068 |
| Heavy Atoms | 29 |
| Complexity | 1062.4823 |
Chemical Identifiers
| CAS Number | 488744-24-7 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C2/C(=C(/C3=CC=C(C=C3)[N+](=O)[O-])\O)/C(=O)C(=O)N2CC(=O)O)F |
Product Overview
{(3E)-2-(2-fluorophenyl)-3-[hydroxy(4-nitrophenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}acetic acid (CAS 488744-24-7), with molecular formula C19H13FN2O7 and molecular weight 400.07 g/mol. IUPAC: 2-[(3E)-2-(2-fluorophenyl)-3-[hydroxy-(4-nitrophenyl)methylidene]-4,5-dioxopyrrolidin-1-yl]acetic acid.
Chemical Property Profile of {(3E)-2-(2-fluorophenyl)-3-[hydroxy(4-nitrophenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}acetic acid
Property Insights of {(3E)-2-(2-fluorophenyl)-3-[hydroxy(4-nitrophenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}acetic acid
The XLogP value of 2.2402 suggests moderate lipophilicity, balancing water solubility and membrane permeability for {(3E)-2-(2-fluorophenyl)-3-[hydroxy(4-nitrophenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}acetic acid. The TPSA of 138.05 Ų falls within the moderate polarity range, balancing permeability and solubility for {(3E)-2-(2-fluorophenyl)-3-[hydroxy(4-nitrophenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}acetic acid. Following Lipinski's Rule of Five, {(3E)-2-(2-fluorophenyl)-3-[hydroxy(4-nitrophenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}acetic acid 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 {(3E)-2-(2-fluorophenyl)-3-[hydroxy(4-nitrophenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}acetic acid?
The CAS number of {(3E)-2-(2-fluorophenyl)-3-[hydroxy(4-nitrophenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}acetic acid is 488744-24-7.
What is the molecular formula of {(3E)-2-(2-fluorophenyl)-3-[hydroxy(4-nitrophenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}acetic acid?
The molecular formula of {(3E)-2-(2-fluorophenyl)-3-[hydroxy(4-nitrophenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}acetic acid is C19H13FN2O7.
What is the molecular weight of {(3E)-2-(2-fluorophenyl)-3-[hydroxy(4-nitrophenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}acetic acid?
The molecular weight of {(3E)-2-(2-fluorophenyl)-3-[hydroxy(4-nitrophenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}acetic acid is 400.07 g/mol.
Where can I buy {(3E)-2-(2-fluorophenyl)-3-[hydroxy(4-nitrophenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}acetic acid?
You can request a quote for {(3E)-2-(2-fluorophenyl)-3-[hydroxy(4-nitrophenyl)methylidene]-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)-2-(2-fluorophenyl)-3-[hydroxy(4-nitrophenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}acetic acid?
Yes, KEHONG BIO provides custom synthesis services for {(3E)-2-(2-fluorophenyl)-3-[hydroxy(4-nitrophenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.