1-Phenethyl-1H-benzoimidazole-2-sulfonic acid
TL;DR: 1-Phenethyl-1H-benzoimidazole-2-sulfonic acid (CAS 537010-01-8) is a chemical compound with molecular formula C15H14N2O3S and molecular weight 302.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-phenylethyl)benzimidazole-2-sulfonic acid
Also Known As: BAS 05465458, 1-Phenethyl-1H-benzoimidazole-2-sulfonic acid, 1-phenethylbenzimidazole-2-sulfonic acid, 1-(2-phenylethyl)benzimidazole-2-sulfonic acid, 1-phenethyl-1H-benzo[d]imidazole-2-sulfonic acid
| Molecular Formula | C15H14N2O3S |
|---|---|
| Molecular Weight | 302.07 g/mol |
| LogP | 2.5257 |
| Topological Polar Surface Area | 72.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 302.0725 |
| Heavy Atoms | 21 |
| Complexity | 870.32996 |
Chemical Identifiers
| CAS Number | 537010-01-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCN2C3=CC=CC=C3N=C2S(=O)(=O)O |
Product Overview
1-Phenethyl-1H-benzoimidazole-2-sulfonic acid (CAS 537010-01-8), with molecular formula C15H14N2O3S and molecular weight 302.07 g/mol. IUPAC: 1-(2-phenylethyl)benzimidazole-2-sulfonic acid.
Chemical Property Profile of 1-Phenethyl-1H-benzoimidazole-2-sulfonic acid
Property Insights of 1-Phenethyl-1H-benzoimidazole-2-sulfonic acid
The XLogP value of 2.5257 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Phenethyl-1H-benzoimidazole-2-sulfonic acid. The TPSA of 72.19 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Phenethyl-1H-benzoimidazole-2-sulfonic acid. Following Lipinski's Rule of Five, 1-Phenethyl-1H-benzoimidazole-2-sulfonic acid has 1 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 1-Phenethyl-1H-benzoimidazole-2-sulfonic acid?
The CAS number of 1-Phenethyl-1H-benzoimidazole-2-sulfonic acid is 537010-01-8.
What is the molecular formula of 1-Phenethyl-1H-benzoimidazole-2-sulfonic acid?
The molecular formula of 1-Phenethyl-1H-benzoimidazole-2-sulfonic acid is C15H14N2O3S.
What is the molecular weight of 1-Phenethyl-1H-benzoimidazole-2-sulfonic acid?
The molecular weight of 1-Phenethyl-1H-benzoimidazole-2-sulfonic acid is 302.07 g/mol.
Where can I buy 1-Phenethyl-1H-benzoimidazole-2-sulfonic acid?
You can request a quote for 1-Phenethyl-1H-benzoimidazole-2-sulfonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Phenethyl-1H-benzoimidazole-2-sulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-Phenethyl-1H-benzoimidazole-2-sulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.