{2-[(4-acetylphenoxy)methyl]-1H-benzimidazol-1-yl}acetic acid
TL;DR: {2-[(4-acetylphenoxy)methyl]-1H-benzimidazol-1-yl}acetic acid (CAS 891449-08-4) is a chemical compound with molecular formula C18H16N2O4 and molecular weight 324.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[(4-acetylphenoxy)methyl]benzimidazol-1-yl]acetic acid
Also Known As: {2-[(4-acetylphenoxy)methyl]-1H-benzimidazol-1-yl}acetic acid, 2229AF, 2-[2-[(4-acetylphenoxy)methyl]benzimidazol-1-yl]acetic acid, [2-(4-acetylphenoxymethyl)-1,3-benzodiazol-1-yl]acetic acid, 2-[2-[(4-acetylphenoxy)methyl]benzoimidazol-1-yl]acetic Acid
| Molecular Formula | C18H16N2O4 |
|---|---|
| Molecular Weight | 324.11 g/mol |
| LogP | 2.9025 |
| Topological Polar Surface Area | 81.42 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 324.111 |
| Heavy Atoms | 24 |
| Complexity | 897.0277 |
Chemical Identifiers
| CAS Number | 891449-08-4 |
|---|---|
| SMILES | CC(=O)C1=CC=C(C=C1)OCC2=NC3=CC=CC=C3N2CC(=O)O |
Product Overview
{2-[(4-acetylphenoxy)methyl]-1H-benzimidazol-1-yl}acetic acid (CAS 891449-08-4), with molecular formula C18H16N2O4 and molecular weight 324.11 g/mol. IUPAC: 2-[2-[(4-acetylphenoxy)methyl]benzimidazol-1-yl]acetic acid.
Chemical Property Profile of {2-[(4-acetylphenoxy)methyl]-1H-benzimidazol-1-yl}acetic acid
Property Insights of {2-[(4-acetylphenoxy)methyl]-1H-benzimidazol-1-yl}acetic acid
The XLogP value of 2.9025 suggests moderate lipophilicity, balancing water solubility and membrane permeability for {2-[(4-acetylphenoxy)methyl]-1H-benzimidazol-1-yl}acetic acid. The TPSA of 81.42 Ų falls within the moderate polarity range, balancing permeability and solubility for {2-[(4-acetylphenoxy)methyl]-1H-benzimidazol-1-yl}acetic acid. Following Lipinski's Rule of Five, {2-[(4-acetylphenoxy)methyl]-1H-benzimidazol-1-yl}acetic acid has 1 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-acetylphenoxy)methyl]-1H-benzimidazol-1-yl}acetic acid?
The CAS number of {2-[(4-acetylphenoxy)methyl]-1H-benzimidazol-1-yl}acetic acid is 891449-08-4.
What is the molecular formula of {2-[(4-acetylphenoxy)methyl]-1H-benzimidazol-1-yl}acetic acid?
The molecular formula of {2-[(4-acetylphenoxy)methyl]-1H-benzimidazol-1-yl}acetic acid is C18H16N2O4.
What is the molecular weight of {2-[(4-acetylphenoxy)methyl]-1H-benzimidazol-1-yl}acetic acid?
The molecular weight of {2-[(4-acetylphenoxy)methyl]-1H-benzimidazol-1-yl}acetic acid is 324.11 g/mol.
Where can I buy {2-[(4-acetylphenoxy)methyl]-1H-benzimidazol-1-yl}acetic acid?
You can request a quote for {2-[(4-acetylphenoxy)methyl]-1H-benzimidazol-1-yl}acetic 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-acetylphenoxy)methyl]-1H-benzimidazol-1-yl}acetic acid?
Yes, KEHONG BIO provides custom synthesis services for {2-[(4-acetylphenoxy)methyl]-1H-benzimidazol-1-yl}acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.