![2-{[2-(benzylsulfanyl)-1H-benzimidazol-1-yl]carbonyl}benzoic acid structure](/static/products/369/369398-23-2.png)
2-{[2-(benzylsulfanyl)-1H-benzimidazol-1-yl]carbonyl}benzoic acid
TL;DR: 2-{[2-(benzylsulfanyl)-1H-benzimidazol-1-yl]carbonyl}benzoic acid (CAS 369398-23-2) is a chemical compound with molecular formula C22H16N2O3S and molecular weight 388.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-benzylsulfanylbenzimidazole-1-carbonyl)benzoic acid
Also Known As: 2-(2-benzylsulfanylbenzimidazole-1-carbonyl)benzoic acid, 2-(2-benzylsulfanylbenzoimidazole-1-carbonyl)benzoic Acid, 2-(2-(benzylthio)-1H-benzo[d]imidazole-1-carbonyl)benzoic acid, 2-{[2-(benzylsulfanyl)-1H-benzimidazol-1-yl]carbonyl}benzoic acid
| Molecular Formula | C22H16N2O3S |
|---|---|
| Molecular Weight | 388.09 g/mol |
| LogP | 4.7153 |
| Topological Polar Surface Area | 72.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 388.08817 |
| Heavy Atoms | 28 |
| Complexity | 1168.8541 |
Chemical Identifiers
| CAS Number | 369398-23-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)CSC2=NC3=CC=CC=C3N2C(=O)C4=CC=CC=C4C(=O)O |
Product Overview
2-{[2-(benzylsulfanyl)-1H-benzimidazol-1-yl]carbonyl}benzoic acid (CAS 369398-23-2), with molecular formula C22H16N2O3S and molecular weight 388.09 g/mol. IUPAC: 2-(2-benzylsulfanylbenzimidazole-1-carbonyl)benzoic acid.
Chemical Property Profile of 2-{[2-(benzylsulfanyl)-1H-benzimidazol-1-yl]carbonyl}benzoic acid
Property Insights of 2-{[2-(benzylsulfanyl)-1H-benzimidazol-1-yl]carbonyl}benzoic acid
The XLogP value of 4.7153 indicates that 2-{[2-(benzylsulfanyl)-1H-benzimidazol-1-yl]carbonyl}benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.19 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{[2-(benzylsulfanyl)-1H-benzimidazol-1-yl]carbonyl}benzoic acid. Following Lipinski's Rule of Five, 2-{[2-(benzylsulfanyl)-1H-benzimidazol-1-yl]carbonyl}benzoic 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-{[2-(benzylsulfanyl)-1H-benzimidazol-1-yl]carbonyl}benzoic acid?
The CAS number of 2-{[2-(benzylsulfanyl)-1H-benzimidazol-1-yl]carbonyl}benzoic acid is 369398-23-2.
What is the molecular formula of 2-{[2-(benzylsulfanyl)-1H-benzimidazol-1-yl]carbonyl}benzoic acid?
The molecular formula of 2-{[2-(benzylsulfanyl)-1H-benzimidazol-1-yl]carbonyl}benzoic acid is C22H16N2O3S.
What is the molecular weight of 2-{[2-(benzylsulfanyl)-1H-benzimidazol-1-yl]carbonyl}benzoic acid?
The molecular weight of 2-{[2-(benzylsulfanyl)-1H-benzimidazol-1-yl]carbonyl}benzoic acid is 388.09 g/mol.
Where can I buy 2-{[2-(benzylsulfanyl)-1H-benzimidazol-1-yl]carbonyl}benzoic acid?
You can request a quote for 2-{[2-(benzylsulfanyl)-1H-benzimidazol-1-yl]carbonyl}benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{[2-(benzylsulfanyl)-1H-benzimidazol-1-yl]carbonyl}benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-{[2-(benzylsulfanyl)-1H-benzimidazol-1-yl]carbonyl}benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.