![3-[(2-Acetyloxy-5-bromobenzoyl)amino]benzoic acid structure](/static/products/7006/7006-93-1.webp)
3-[(2-Acetyloxy-5-bromobenzoyl)amino]benzoic acid
TL;DR: 3-[(2-Acetyloxy-5-bromobenzoyl)amino]benzoic acid (CAS 7006-93-1) is a chemical compound with molecular formula C16H12BrNO5 and molecular weight 376.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(2-acetyloxy-5-bromobenzoyl)amino]benzoic acid
Also Known As: 3-[(2-acetyloxy-5-bromobenzoyl)amino]benzoic acid, 3-[2-(Acetyloxy)-5-bromobenzamido]benzoic acid, 3-[(2-acetyloxy-5-bromo-benzoyl)amino]benzoic Acid
| Molecular Formula | C16H12BrNO5 |
|---|---|
| Molecular Weight | 376.99 g/mol |
| LogP | 3.3249 |
| Topological Polar Surface Area | 92.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 376.9899 |
| Heavy Atoms | 23 |
| Complexity | 787.7901 |
Chemical Identifiers
| CAS Number | 7006-93-1 |
|---|---|
| SMILES | CC(=O)OC1=C(C=C(C=C1)Br)C(=O)NC2=CC=CC(=C2)C(=O)O |
Product Overview
3-[(2-Acetyloxy-5-bromobenzoyl)amino]benzoic acid (CAS 7006-93-1), with molecular formula C16H12BrNO5 and molecular weight 376.99 g/mol. IUPAC: 3-[(2-acetyloxy-5-bromobenzoyl)amino]benzoic acid.
Chemical Property Profile of 3-[(2-Acetyloxy-5-bromobenzoyl)amino]benzoic acid
Property Insights of 3-[(2-Acetyloxy-5-bromobenzoyl)amino]benzoic acid
The XLogP value of 3.3249 indicates that 3-[(2-Acetyloxy-5-bromobenzoyl)amino]benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(2-Acetyloxy-5-bromobenzoyl)amino]benzoic acid. Following Lipinski's Rule of Five, 3-[(2-Acetyloxy-5-bromobenzoyl)amino]benzoic acid has 2 hydrogen bond donor(s) and 4 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-[(2-Acetyloxy-5-bromobenzoyl)amino]benzoic acid?
The CAS number of 3-[(2-Acetyloxy-5-bromobenzoyl)amino]benzoic acid is 7006-93-1.
What is the molecular formula of 3-[(2-Acetyloxy-5-bromobenzoyl)amino]benzoic acid?
The molecular formula of 3-[(2-Acetyloxy-5-bromobenzoyl)amino]benzoic acid is C16H12BrNO5.
What is the molecular weight of 3-[(2-Acetyloxy-5-bromobenzoyl)amino]benzoic acid?
The molecular weight of 3-[(2-Acetyloxy-5-bromobenzoyl)amino]benzoic acid is 376.99 g/mol.
Where can I buy 3-[(2-Acetyloxy-5-bromobenzoyl)amino]benzoic acid?
You can request a quote for 3-[(2-Acetyloxy-5-bromobenzoyl)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 3-[(2-Acetyloxy-5-bromobenzoyl)amino]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[(2-Acetyloxy-5-bromobenzoyl)amino]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.