2-(4-((2-Methoxyphenyl)amino)-4-oxobutan-2-yl)hexanoic acid
TL;DR: 2-(4-((2-Methoxyphenyl)amino)-4-oxobutan-2-yl)hexanoic acid (CAS 439138-60-0) is a chemical compound with molecular formula C17H25NO4 and molecular weight 307.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(2-methoxyanilino)-4-oxobutan-2-yl]hexanoic acid
Also Known As: 2-[4-(2-methoxyanilino)-4-oxobutan-2-yl]hexanoic acid, 2-(4-((2-methoxyphenyl)amino)-4-oxobutan-2-yl)hexanoic acid, 2-{4-[(2-methoxyphenyl)amino]-4-oxobutan-2-yl}hexanoic acid, 2-{1-[(2-METHOXYPHENYL)CARBAMOYL]PROPAN-2-YL}HEXANOIC ACID
| Molecular Formula | C17H25NO4 |
|---|---|
| Molecular Weight | 307.18 g/mol |
| LogP | 3.5509 |
| Topological Polar Surface Area | 75.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 307.17834 |
| Heavy Atoms | 22 |
| Complexity | 501.18723 |
Chemical Identifiers
| CAS Number | 439138-60-0 |
|---|---|
| SMILES | CCCCC(C(C)CC(=O)NC1=CC=CC=C1OC)C(=O)O |
Product Overview
2-(4-((2-Methoxyphenyl)amino)-4-oxobutan-2-yl)hexanoic acid (CAS 439138-60-0), with molecular formula C17H25NO4 and molecular weight 307.18 g/mol. IUPAC: 2-[4-(2-methoxyanilino)-4-oxobutan-2-yl]hexanoic acid.
Chemical Property Profile of 2-(4-((2-Methoxyphenyl)amino)-4-oxobutan-2-yl)hexanoic acid
Property Insights of 2-(4-((2-Methoxyphenyl)amino)-4-oxobutan-2-yl)hexanoic acid
The XLogP value of 3.5509 indicates that 2-(4-((2-Methoxyphenyl)amino)-4-oxobutan-2-yl)hexanoic 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 2-(4-((2-Methoxyphenyl)amino)-4-oxobutan-2-yl)hexanoic acid. Following Lipinski's Rule of Five, 2-(4-((2-Methoxyphenyl)amino)-4-oxobutan-2-yl)hexanoic 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 2-(4-((2-Methoxyphenyl)amino)-4-oxobutan-2-yl)hexanoic acid?
The CAS number of 2-(4-((2-Methoxyphenyl)amino)-4-oxobutan-2-yl)hexanoic acid is 439138-60-0.
What is the molecular formula of 2-(4-((2-Methoxyphenyl)amino)-4-oxobutan-2-yl)hexanoic acid?
The molecular formula of 2-(4-((2-Methoxyphenyl)amino)-4-oxobutan-2-yl)hexanoic acid is C17H25NO4.
What is the molecular weight of 2-(4-((2-Methoxyphenyl)amino)-4-oxobutan-2-yl)hexanoic acid?
The molecular weight of 2-(4-((2-Methoxyphenyl)amino)-4-oxobutan-2-yl)hexanoic acid is 307.18 g/mol.
Where can I buy 2-(4-((2-Methoxyphenyl)amino)-4-oxobutan-2-yl)hexanoic acid?
You can request a quote for 2-(4-((2-Methoxyphenyl)amino)-4-oxobutan-2-yl)hexanoic 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-((2-Methoxyphenyl)amino)-4-oxobutan-2-yl)hexanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-((2-Methoxyphenyl)amino)-4-oxobutan-2-yl)hexanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.