![5-{[(2-Nitrophenoxy)acetyl]amino}isophthalic acid structure](/static/products/4284/428446-43-9.webp)
5-{[(2-Nitrophenoxy)acetyl]amino}isophthalic acid
TL;DR: 5-{[(2-Nitrophenoxy)acetyl]amino}isophthalic acid (CAS 428446-43-9) is a chemical compound with molecular formula C16H12N2O8 and molecular weight 360.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[[2-(2-nitrophenoxy)acetyl]amino]benzene-1,3-dicarboxylic acid
Also Known As: 5-(2-(2-nitrophenoxy)acetamido)isophthalic acid, 5-{[(2-nitrophenoxy)acetyl]amino}isophthalic acid, 5-[[2-(2-nitrophenoxy)acetyl]amino]benzene-1,3-dicarboxylic Acid, 5-{[(2-nitrophenoxy)acetyl]amino}benzene-1,3-dicarboxylic acid, Cambridge id 6392369
| Molecular Formula | C16H12N2O8 |
|---|---|
| Molecular Weight | 360.06 g/mol |
| LogP | 2.0087 |
| Topological Polar Surface Area | 156.07 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 360.05936 |
| Heavy Atoms | 26 |
| Complexity | 861.31854 |
Chemical Identifiers
| CAS Number | 428446-43-9 |
|---|---|
| SMILES | C1=CC=C(C(=C1)[N+](=O)[O-])OCC(=O)NC2=CC(=CC(=C2)C(=O)O)C(=O)O |
Product Overview
5-{[(2-Nitrophenoxy)acetyl]amino}isophthalic acid (CAS 428446-43-9), with molecular formula C16H12N2O8 and molecular weight 360.06 g/mol. IUPAC: 5-[[2-(2-nitrophenoxy)acetyl]amino]benzene-1,3-dicarboxylic acid.
Chemical Property Profile of 5-{[(2-Nitrophenoxy)acetyl]amino}isophthalic acid
Property Insights of 5-{[(2-Nitrophenoxy)acetyl]amino}isophthalic acid
The XLogP value of 2.0087 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-{[(2-Nitrophenoxy)acetyl]amino}isophthalic acid. The TPSA of 156.07 Ų indicates high polarity, suggesting 5-{[(2-Nitrophenoxy)acetyl]amino}isophthalic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5-{[(2-Nitrophenoxy)acetyl]amino}isophthalic acid has 3 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 5-{[(2-Nitrophenoxy)acetyl]amino}isophthalic acid?
The CAS number of 5-{[(2-Nitrophenoxy)acetyl]amino}isophthalic acid is 428446-43-9.
What is the molecular formula of 5-{[(2-Nitrophenoxy)acetyl]amino}isophthalic acid?
The molecular formula of 5-{[(2-Nitrophenoxy)acetyl]amino}isophthalic acid is C16H12N2O8.
What is the molecular weight of 5-{[(2-Nitrophenoxy)acetyl]amino}isophthalic acid?
The molecular weight of 5-{[(2-Nitrophenoxy)acetyl]amino}isophthalic acid is 360.06 g/mol.
Where can I buy 5-{[(2-Nitrophenoxy)acetyl]amino}isophthalic acid?
You can request a quote for 5-{[(2-Nitrophenoxy)acetyl]amino}isophthalic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-{[(2-Nitrophenoxy)acetyl]amino}isophthalic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-{[(2-Nitrophenoxy)acetyl]amino}isophthalic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.