![4-[(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(3-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]butanoic acid structure](/static/products/488/488135-59-7.png)
4-[(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(3-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]butanoic acid
TL;DR: 4-[(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(3-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]butanoic acid (CAS 488135-59-7) is a chemical compound with molecular formula C21H17N3O9 and molecular weight 455.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3E)-3-[hydroxy-(4-nitrophenyl)methylidene]-2-(3-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]butanoic acid
Also Known As: 4-[(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(3-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]butanoic acid, 4-[(3E)-3-[hydroxy-(4-nitrophenyl)methylidene]-2-(3-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]butanoic acid
| Molecular Formula | C21H17N3O9 |
|---|---|
| Molecular Weight | 455.10 g/mol |
| LogP | 2.7895 |
| Topological Polar Surface Area | 181.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 455.09647 |
| Heavy Atoms | 33 |
| Complexity | 1187.7216 |
Chemical Identifiers
| CAS Number | 488135-59-7 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])C2/C(=C(/C3=CC=C(C=C3)[N+](=O)[O-])\O)/C(=O)C(=O)N2CCCC(=O)O |
Product Overview
4-[(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(3-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]butanoic acid (CAS 488135-59-7), with molecular formula C21H17N3O9 and molecular weight 455.10 g/mol. IUPAC: 4-[(3E)-3-[hydroxy-(4-nitrophenyl)methylidene]-2-(3-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]butanoic acid.
Chemical Property Profile of 4-[(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(3-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]butanoic acid
Property Insights of 4-[(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(3-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]butanoic acid
The XLogP value of 2.7895 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(3-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]butanoic acid. The TPSA of 181.19 Ų indicates high polarity, suggesting 4-[(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(3-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]butanoic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-[(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(3-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]butanoic 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 4-[(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(3-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]butanoic acid?
The CAS number of 4-[(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(3-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]butanoic acid is 488135-59-7.
What is the molecular formula of 4-[(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(3-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]butanoic acid?
The molecular formula of 4-[(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(3-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]butanoic acid is C21H17N3O9.
What is the molecular weight of 4-[(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(3-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]butanoic acid?
The molecular weight of 4-[(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(3-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]butanoic acid is 455.10 g/mol.
Where can I buy 4-[(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(3-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]butanoic acid?
You can request a quote for 4-[(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(3-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]butanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(3-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(3-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.