![4-Nitro-2-{[(4-nitrophenyl)acetyl]amino}benzoic acid structure](/static/products/688/688039-32-9.png)
4-Nitro-2-{[(4-nitrophenyl)acetyl]amino}benzoic acid
TL;DR: 4-Nitro-2-{[(4-nitrophenyl)acetyl]amino}benzoic acid (CAS 688039-32-9) is a chemical compound with molecular formula C15H11N3O7 and molecular weight 345.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-nitro-2-[[2-(4-nitrophenyl)acetyl]amino]benzoic acid
Also Known As: 4-nitro-2-{[(4-nitrophenyl)acetyl]amino}benzoic acid, 4-nitro-2-[[2-(4-nitrophenyl)acetyl]amino]benzoic Acid, 4-nitro-2-[2-(4-nitrophenyl)acetylamino]benzoic acid
| Molecular Formula | C15H11N3O7 |
|---|---|
| Molecular Weight | 345.06 g/mol |
| LogP | 2.3824 |
| Topological Polar Surface Area | 152.68 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 345.0597 |
| Heavy Atoms | 25 |
| Complexity | 861.9288 |
Chemical Identifiers
| CAS Number | 688039-32-9 |
|---|---|
| SMILES | C1=CC(=CC=C1CC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])C(=O)O)[N+](=O)[O-] |
Product Overview
4-Nitro-2-{[(4-nitrophenyl)acetyl]amino}benzoic acid (CAS 688039-32-9), with molecular formula C15H11N3O7 and molecular weight 345.06 g/mol. IUPAC: 4-nitro-2-[[2-(4-nitrophenyl)acetyl]amino]benzoic acid.
Chemical Property Profile of 4-Nitro-2-{[(4-nitrophenyl)acetyl]amino}benzoic acid
Property Insights of 4-Nitro-2-{[(4-nitrophenyl)acetyl]amino}benzoic acid
The XLogP value of 2.3824 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Nitro-2-{[(4-nitrophenyl)acetyl]amino}benzoic acid. The TPSA of 152.68 Ų indicates high polarity, suggesting 4-Nitro-2-{[(4-nitrophenyl)acetyl]amino}benzoic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-Nitro-2-{[(4-nitrophenyl)acetyl]amino}benzoic 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 4-Nitro-2-{[(4-nitrophenyl)acetyl]amino}benzoic acid?
The CAS number of 4-Nitro-2-{[(4-nitrophenyl)acetyl]amino}benzoic acid is 688039-32-9.
What is the molecular formula of 4-Nitro-2-{[(4-nitrophenyl)acetyl]amino}benzoic acid?
The molecular formula of 4-Nitro-2-{[(4-nitrophenyl)acetyl]amino}benzoic acid is C15H11N3O7.
What is the molecular weight of 4-Nitro-2-{[(4-nitrophenyl)acetyl]amino}benzoic acid?
The molecular weight of 4-Nitro-2-{[(4-nitrophenyl)acetyl]amino}benzoic acid is 345.06 g/mol.
Where can I buy 4-Nitro-2-{[(4-nitrophenyl)acetyl]amino}benzoic acid?
You can request a quote for 4-Nitro-2-{[(4-nitrophenyl)acetyl]amino}benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Nitro-2-{[(4-nitrophenyl)acetyl]amino}benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Nitro-2-{[(4-nitrophenyl)acetyl]amino}benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.