![4-{[(2-{[(2,6-Dimethylphenoxy)acetyl]amino}phenyl)carbonyl]amino}benzoic acid structure](/static/products/6909/690986-08-4.webp)
4-{[(2-{[(2,6-Dimethylphenoxy)acetyl]amino}phenyl)carbonyl]amino}benzoic acid
TL;DR: 4-{[(2-{[(2,6-Dimethylphenoxy)acetyl]amino}phenyl)carbonyl]amino}benzoic acid (CAS 690986-08-4) is a chemical compound with molecular formula C24H22N2O5 and molecular weight 418.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[2-[[2-(2,6-dimethylphenoxy)acetyl]amino]benzoyl]amino]benzoic acid
Also Known As: CBKinase1_002795, CBKinase1_015195, BRD-K98710307-001-01-0, 4-(2-(2-(2,6-dimethylphenoxy)acetamido)benzamido)benzoic acid, 4-[[2-[[2-(2,6-dimethylphenoxy)acetyl]amino]benzoyl]amino]benzoic Acid
| Molecular Formula | C24H22N2O5 |
|---|---|
| Molecular Weight | 418.15 g/mol |
| LogP | 4.27144 |
| Topological Polar Surface Area | 104.73 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 418.15286 |
| Heavy Atoms | 31 |
| Complexity | 1102.8185 |
Chemical Identifiers
| CAS Number | 690986-08-4 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C)OCC(=O)NC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)C(=O)O |
Product Overview
4-{[(2-{[(2,6-Dimethylphenoxy)acetyl]amino}phenyl)carbonyl]amino}benzoic acid (CAS 690986-08-4), with molecular formula C24H22N2O5 and molecular weight 418.15 g/mol. IUPAC: 4-[[2-[[2-(2,6-dimethylphenoxy)acetyl]amino]benzoyl]amino]benzoic acid.
Chemical Property Profile of 4-{[(2-{[(2,6-Dimethylphenoxy)acetyl]amino}phenyl)carbonyl]amino}benzoic acid
Property Insights of 4-{[(2-{[(2,6-Dimethylphenoxy)acetyl]amino}phenyl)carbonyl]amino}benzoic acid
The XLogP value of 4.27144 indicates that 4-{[(2-{[(2,6-Dimethylphenoxy)acetyl]amino}phenyl)carbonyl]amino}benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.73 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-{[(2-{[(2,6-Dimethylphenoxy)acetyl]amino}phenyl)carbonyl]amino}benzoic acid. Following Lipinski's Rule of Five, 4-{[(2-{[(2,6-Dimethylphenoxy)acetyl]amino}phenyl)carbonyl]amino}benzoic acid has 3 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 4-{[(2-{[(2,6-Dimethylphenoxy)acetyl]amino}phenyl)carbonyl]amino}benzoic acid?
The CAS number of 4-{[(2-{[(2,6-Dimethylphenoxy)acetyl]amino}phenyl)carbonyl]amino}benzoic acid is 690986-08-4.
What is the molecular formula of 4-{[(2-{[(2,6-Dimethylphenoxy)acetyl]amino}phenyl)carbonyl]amino}benzoic acid?
The molecular formula of 4-{[(2-{[(2,6-Dimethylphenoxy)acetyl]amino}phenyl)carbonyl]amino}benzoic acid is C24H22N2O5.
What is the molecular weight of 4-{[(2-{[(2,6-Dimethylphenoxy)acetyl]amino}phenyl)carbonyl]amino}benzoic acid?
The molecular weight of 4-{[(2-{[(2,6-Dimethylphenoxy)acetyl]amino}phenyl)carbonyl]amino}benzoic acid is 418.15 g/mol.
Where can I buy 4-{[(2-{[(2,6-Dimethylphenoxy)acetyl]amino}phenyl)carbonyl]amino}benzoic acid?
You can request a quote for 4-{[(2-{[(2,6-Dimethylphenoxy)acetyl]amino}phenyl)carbonyl]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 4-{[(2-{[(2,6-Dimethylphenoxy)acetyl]amino}phenyl)carbonyl]amino}benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-{[(2-{[(2,6-Dimethylphenoxy)acetyl]amino}phenyl)carbonyl]amino}benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.