![2-{[(4-Bromophenyl)acetyl]amino}-4,5-dimethoxybenzoic acid structure](/static/products/897/897791-25-2.png)
2-{[(4-Bromophenyl)acetyl]amino}-4,5-dimethoxybenzoic acid
TL;DR: 2-{[(4-Bromophenyl)acetyl]amino}-4,5-dimethoxybenzoic acid (CAS 897791-25-2) is a chemical compound with molecular formula C17H16BrNO5 and molecular weight 393.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[2-(4-bromophenyl)acetyl]amino]-4,5-dimethoxybenzoic acid
Also Known As: 2-(2-(4-bromophenyl)acetamido)-4,5-dimethoxybenzoic acid, 2-[[2-(4-bromophenyl)acetyl]amino]-4,5-dimethoxybenzoic acid, 2-{[(4-bromophenyl)acetyl]amino}-4,5-dimethoxybenzoic acid, 2-[[2-(4-bromophenyl)acetyl]amino]-4,5-dimethoxy-benzoic Acid
| Molecular Formula | C17H16BrNO5 |
|---|---|
| Molecular Weight | 393.02 g/mol |
| LogP | 3.3457 |
| Topological Polar Surface Area | 84.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 393.02118 |
| Heavy Atoms | 24 |
| Complexity | 758.32135 |
Chemical Identifiers
| CAS Number | 897791-25-2 |
|---|---|
| SMILES | COC1=C(C=C(C(=C1)C(=O)O)NC(=O)CC2=CC=C(C=C2)Br)OC |
Product Overview
2-{[(4-Bromophenyl)acetyl]amino}-4,5-dimethoxybenzoic acid (CAS 897791-25-2), with molecular formula C17H16BrNO5 and molecular weight 393.02 g/mol. IUPAC: 2-[[2-(4-bromophenyl)acetyl]amino]-4,5-dimethoxybenzoic acid.
Chemical Property Profile of 2-{[(4-Bromophenyl)acetyl]amino}-4,5-dimethoxybenzoic acid
Property Insights of 2-{[(4-Bromophenyl)acetyl]amino}-4,5-dimethoxybenzoic acid
The XLogP value of 3.3457 indicates that 2-{[(4-Bromophenyl)acetyl]amino}-4,5-dimethoxybenzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.86 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{[(4-Bromophenyl)acetyl]amino}-4,5-dimethoxybenzoic acid. Following Lipinski's Rule of Five, 2-{[(4-Bromophenyl)acetyl]amino}-4,5-dimethoxybenzoic 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 2-{[(4-Bromophenyl)acetyl]amino}-4,5-dimethoxybenzoic acid?
The CAS number of 2-{[(4-Bromophenyl)acetyl]amino}-4,5-dimethoxybenzoic acid is 897791-25-2.
What is the molecular formula of 2-{[(4-Bromophenyl)acetyl]amino}-4,5-dimethoxybenzoic acid?
The molecular formula of 2-{[(4-Bromophenyl)acetyl]amino}-4,5-dimethoxybenzoic acid is C17H16BrNO5.
What is the molecular weight of 2-{[(4-Bromophenyl)acetyl]amino}-4,5-dimethoxybenzoic acid?
The molecular weight of 2-{[(4-Bromophenyl)acetyl]amino}-4,5-dimethoxybenzoic acid is 393.02 g/mol.
Where can I buy 2-{[(4-Bromophenyl)acetyl]amino}-4,5-dimethoxybenzoic acid?
You can request a quote for 2-{[(4-Bromophenyl)acetyl]amino}-4,5-dimethoxybenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{[(4-Bromophenyl)acetyl]amino}-4,5-dimethoxybenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-{[(4-Bromophenyl)acetyl]amino}-4,5-dimethoxybenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.