![3-[(1E)-3-(4-Bromophenyl)triaz-1-EN-1-YL]-5-nitrobenzoic acid structure](/static/products/318/318271-35-1.png)
3-[(1E)-3-(4-Bromophenyl)triaz-1-EN-1-YL]-5-nitrobenzoic acid
TL;DR: 3-[(1E)-3-(4-Bromophenyl)triaz-1-EN-1-YL]-5-nitrobenzoic acid (CAS 318271-35-1) is a chemical compound with molecular formula C13H9BrN4O4 and molecular weight 363.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-(4-bromophenyl)iminohydrazinyl]-5-nitrobenzoic acid
Also Known As: AH-034/11366560, 3-[3-(4-bromophenyl)-2-triazenyl]-5-nitrobenzoic acid, 3-[2-(4-bromophenyl)iminohydrazinyl]-5-nitro-benzoic Acid, 3-[2-(4-bromophenyl)iminohydrazinyl]-5-nitrobenzoic acid, 3-[3-(4-bromophenyl)-2-triazen-1-yl]-5-nitrobenzoic acid
| Molecular Formula | C13H9BrN4O4 |
|---|---|
| Molecular Weight | 363.98 g/mol |
| LogP | 4.1663 |
| Topological Polar Surface Area | 117.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 363.9807 |
| Heavy Atoms | 22 |
| Complexity | 713.9553 |
Chemical Identifiers
| CAS Number | 318271-35-1 |
|---|---|
| SMILES | C1=CC(=CC=C1N=NNC2=CC(=CC(=C2)C(=O)O)[N+](=O)[O-])Br |
Product Overview
3-[(1E)-3-(4-Bromophenyl)triaz-1-EN-1-YL]-5-nitrobenzoic acid (CAS 318271-35-1), with molecular formula C13H9BrN4O4 and molecular weight 363.98 g/mol. IUPAC: 3-[2-(4-bromophenyl)iminohydrazinyl]-5-nitrobenzoic acid.
Chemical Property Profile of 3-[(1E)-3-(4-Bromophenyl)triaz-1-EN-1-YL]-5-nitrobenzoic acid
Property Insights of 3-[(1E)-3-(4-Bromophenyl)triaz-1-EN-1-YL]-5-nitrobenzoic acid
The XLogP value of 4.1663 indicates that 3-[(1E)-3-(4-Bromophenyl)triaz-1-EN-1-YL]-5-nitrobenzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 117.19 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(1E)-3-(4-Bromophenyl)triaz-1-EN-1-YL]-5-nitrobenzoic acid. Following Lipinski's Rule of Five, 3-[(1E)-3-(4-Bromophenyl)triaz-1-EN-1-YL]-5-nitrobenzoic acid has 2 hydrogen bond donor(s) and 5 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 3-[(1E)-3-(4-Bromophenyl)triaz-1-EN-1-YL]-5-nitrobenzoic acid?
The CAS number of 3-[(1E)-3-(4-Bromophenyl)triaz-1-EN-1-YL]-5-nitrobenzoic acid is 318271-35-1.
What is the molecular formula of 3-[(1E)-3-(4-Bromophenyl)triaz-1-EN-1-YL]-5-nitrobenzoic acid?
The molecular formula of 3-[(1E)-3-(4-Bromophenyl)triaz-1-EN-1-YL]-5-nitrobenzoic acid is C13H9BrN4O4.
What is the molecular weight of 3-[(1E)-3-(4-Bromophenyl)triaz-1-EN-1-YL]-5-nitrobenzoic acid?
The molecular weight of 3-[(1E)-3-(4-Bromophenyl)triaz-1-EN-1-YL]-5-nitrobenzoic acid is 363.98 g/mol.
Where can I buy 3-[(1E)-3-(4-Bromophenyl)triaz-1-EN-1-YL]-5-nitrobenzoic acid?
You can request a quote for 3-[(1E)-3-(4-Bromophenyl)triaz-1-EN-1-YL]-5-nitrobenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(1E)-3-(4-Bromophenyl)triaz-1-EN-1-YL]-5-nitrobenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[(1E)-3-(4-Bromophenyl)triaz-1-EN-1-YL]-5-nitrobenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.