![3-[[2-(4-Bromophenoxy)acetyl]amino]-2-methylbenzoic acid structure](/static/products/7012/701260-19-7.webp)
3-[[2-(4-Bromophenoxy)acetyl]amino]-2-methylbenzoic acid
TL;DR: 3-[[2-(4-Bromophenoxy)acetyl]amino]-2-methylbenzoic acid (CAS 701260-19-7) is a chemical compound with molecular formula C16H14BrNO4 and molecular weight 363.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[2-(4-bromophenoxy)acetyl]amino]-2-methylbenzoic acid
Also Known As: CBKinase1_006720, CBKinase1_019120, 3-[[2-(4-bromophenoxy)acetyl]amino]-2-methylbenzoic acid, 3-{[(4-bromophenoxy)acetyl]amino}-2-methylbenzoic acid, 3-[2-(4-bromophenoxy)acetamido]-2-methylbenzoic acid
| Molecular Formula | C16H14BrNO4 |
|---|---|
| Molecular Weight | 363.01 g/mol |
| LogP | 3.47322 |
| Topological Polar Surface Area | 75.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 363.01062 |
| Heavy Atoms | 22 |
| Complexity | 697.79205 |
Chemical Identifiers
| CAS Number | 701260-19-7 |
|---|---|
| SMILES | CC1=C(C=CC=C1NC(=O)COC2=CC=C(C=C2)Br)C(=O)O |
Product Overview
3-[[2-(4-Bromophenoxy)acetyl]amino]-2-methylbenzoic acid (CAS 701260-19-7), with molecular formula C16H14BrNO4 and molecular weight 363.01 g/mol. IUPAC: 3-[[2-(4-bromophenoxy)acetyl]amino]-2-methylbenzoic acid.
Chemical Property Profile of 3-[[2-(4-Bromophenoxy)acetyl]amino]-2-methylbenzoic acid
Property Insights of 3-[[2-(4-Bromophenoxy)acetyl]amino]-2-methylbenzoic acid
The XLogP value of 3.47322 indicates that 3-[[2-(4-Bromophenoxy)acetyl]amino]-2-methylbenzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.63 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[[2-(4-Bromophenoxy)acetyl]amino]-2-methylbenzoic acid. Following Lipinski's Rule of Five, 3-[[2-(4-Bromophenoxy)acetyl]amino]-2-methylbenzoic acid has 2 hydrogen bond donor(s) and 3 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-(4-Bromophenoxy)acetyl]amino]-2-methylbenzoic acid?
The CAS number of 3-[[2-(4-Bromophenoxy)acetyl]amino]-2-methylbenzoic acid is 701260-19-7.
What is the molecular formula of 3-[[2-(4-Bromophenoxy)acetyl]amino]-2-methylbenzoic acid?
The molecular formula of 3-[[2-(4-Bromophenoxy)acetyl]amino]-2-methylbenzoic acid is C16H14BrNO4.
What is the molecular weight of 3-[[2-(4-Bromophenoxy)acetyl]amino]-2-methylbenzoic acid?
The molecular weight of 3-[[2-(4-Bromophenoxy)acetyl]amino]-2-methylbenzoic acid is 363.01 g/mol.
Where can I buy 3-[[2-(4-Bromophenoxy)acetyl]amino]-2-methylbenzoic acid?
You can request a quote for 3-[[2-(4-Bromophenoxy)acetyl]amino]-2-methylbenzoic 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-(4-Bromophenoxy)acetyl]amino]-2-methylbenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[[2-(4-Bromophenoxy)acetyl]amino]-2-methylbenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.