![4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]benzoic acid structure](/static/products/303/303115-88-0.png)
4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]benzoic acid
TL;DR: 4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]benzoic acid (CAS 303115-88-0) is a chemical compound with molecular formula C17H11N3O2 and molecular weight 289.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]benzoic acid
Also Known As: BAS 09105259, 4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]benzoic acid, 4-((1E)-2-benzimidazol-2-yl-2-cyanovinyl)benzoic acid, 4-[2-(1H-Benzoimidazol-2-yl)-2-cyano-vinyl]-benzoic acid, 4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-vinyl]benzoic acid
| Molecular Formula | C17H11N3O2 |
|---|---|
| Molecular Weight | 289.09 g/mol |
| LogP | 3.32528 |
| Topological Polar Surface Area | 89.77 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 289.0851 |
| Heavy Atoms | 22 |
| Complexity | 881.9771 |
Chemical Identifiers
| CAS Number | 303115-88-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)NC(=N2)/C(=C/C3=CC=C(C=C3)C(=O)O)/C#N |
Product Overview
4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]benzoic acid (CAS 303115-88-0), with molecular formula C17H11N3O2 and molecular weight 289.09 g/mol. IUPAC: 4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]benzoic acid.
Chemical Property Profile of 4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]benzoic acid
Property Insights of 4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]benzoic acid
The XLogP value of 3.32528 indicates that 4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.77 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]benzoic acid. Following Lipinski's Rule of Five, 4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]benzoic 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 4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]benzoic acid?
The CAS number of 4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]benzoic acid is 303115-88-0.
What is the molecular formula of 4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]benzoic acid?
The molecular formula of 4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]benzoic acid is C17H11N3O2.
What is the molecular weight of 4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]benzoic acid?
The molecular weight of 4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]benzoic acid is 289.09 g/mol.
Where can I buy 4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]benzoic acid?
You can request a quote for 4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]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-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.