2-(hydroxymethyl)-1H-benzimidazole-5-sulfonic acid
TL;DR: 2-(hydroxymethyl)-1H-benzimidazole-5-sulfonic acid (CAS 450353-95-4) is a chemical compound with molecular formula C8H8N2O4S and molecular weight 228.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(hydroxymethyl)-3H-benzimidazole-5-sulfonic acid
Also Known As: BAS 03422175, 1H-Benzimidazole-6-sulfonic acid, 2-(hydroxymethyl)-, 2-Hydroxymethyl-1H-benzoimidazole-5-sulfonic acid, AM-760/15122003, 2-(hydroxymethyl)-1H-benzimidazole-5-sulfonic acid
| Molecular Formula | C8H8N2O4S |
|---|---|
| Molecular Weight | 228.02 g/mol |
| LogP | 0.3019 |
| Topological Polar Surface Area | 103.28 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 228.02048 |
| Heavy Atoms | 15 |
| Complexity | 602.1292 |
Chemical Identifiers
| CAS Number | 450353-95-4 |
|---|---|
| SMILES | C1=CC2=C(C=C1S(=O)(=O)O)NC(=N2)CO |
Product Overview
2-(hydroxymethyl)-1H-benzimidazole-5-sulfonic acid (CAS 450353-95-4), with molecular formula C8H8N2O4S and molecular weight 228.02 g/mol. IUPAC: 2-(hydroxymethyl)-3H-benzimidazole-5-sulfonic acid.
Chemical Property Profile of 2-(hydroxymethyl)-1H-benzimidazole-5-sulfonic acid
Property Insights of 2-(hydroxymethyl)-1H-benzimidazole-5-sulfonic acid
The XLogP value of 0.3019 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(hydroxymethyl)-1H-benzimidazole-5-sulfonic acid. The TPSA of 103.28 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(hydroxymethyl)-1H-benzimidazole-5-sulfonic acid. Following Lipinski's Rule of Five, 2-(hydroxymethyl)-1H-benzimidazole-5-sulfonic 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 2-(hydroxymethyl)-1H-benzimidazole-5-sulfonic acid?
The CAS number of 2-(hydroxymethyl)-1H-benzimidazole-5-sulfonic acid is 450353-95-4.
What is the molecular formula of 2-(hydroxymethyl)-1H-benzimidazole-5-sulfonic acid?
The molecular formula of 2-(hydroxymethyl)-1H-benzimidazole-5-sulfonic acid is C8H8N2O4S.
What is the molecular weight of 2-(hydroxymethyl)-1H-benzimidazole-5-sulfonic acid?
The molecular weight of 2-(hydroxymethyl)-1H-benzimidazole-5-sulfonic acid is 228.02 g/mol.
Where can I buy 2-(hydroxymethyl)-1H-benzimidazole-5-sulfonic acid?
You can request a quote for 2-(hydroxymethyl)-1H-benzimidazole-5-sulfonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(hydroxymethyl)-1H-benzimidazole-5-sulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(hydroxymethyl)-1H-benzimidazole-5-sulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.