1H-Benzimidazole-6-sulfonic acid, 2-butyl-
TL;DR: 1H-Benzimidazole-6-sulfonic acid, 2-butyl- (CAS 220520-50-3) is a chemical compound with molecular formula C11H14N2O3S and molecular weight 254.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-butyl-3H-benzimidazole-5-sulfonic acid
Also Known As: 1H-Benzimidazole-6-sulfonic acid, 2-butyl-, 2-butylbenzimidazole-5-sulfonic acid, 2-butyl-3H-benzimidazole-5-sulfonic acid, 2-butyl-1H-benzimidazole-5-sulfonic acid, 2-butyl-1H-benzimidazole-6-sulfonic acid
| Molecular Formula | C11H14N2O3S |
|---|---|
| Molecular Weight | 254.07 g/mol |
| LogP | 2.1522 |
| Topological Polar Surface Area | 83.05 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 254.07251 |
| Heavy Atoms | 17 |
| Complexity | 631.204 |
Chemical Identifiers
| CAS Number | 220520-50-3 |
|---|---|
| SMILES | CCCCC1=NC2=C(N1)C=C(C=C2)S(=O)(=O)O |
Product Overview
1H-Benzimidazole-6-sulfonic acid, 2-butyl- (CAS 220520-50-3), with molecular formula C11H14N2O3S and molecular weight 254.07 g/mol. IUPAC: 2-butyl-3H-benzimidazole-5-sulfonic acid.
Chemical Property Profile of 1H-Benzimidazole-6-sulfonic acid, 2-butyl-
Property Insights of 1H-Benzimidazole-6-sulfonic acid, 2-butyl-
The XLogP value of 2.1522 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Benzimidazole-6-sulfonic acid, 2-butyl-. The TPSA of 83.05 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Benzimidazole-6-sulfonic acid, 2-butyl-. Following Lipinski's Rule of Five, 1H-Benzimidazole-6-sulfonic acid, 2-butyl- 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 1H-Benzimidazole-6-sulfonic acid, 2-butyl-?
The CAS number of 1H-Benzimidazole-6-sulfonic acid, 2-butyl- is 220520-50-3.
What is the molecular formula of 1H-Benzimidazole-6-sulfonic acid, 2-butyl-?
The molecular formula of 1H-Benzimidazole-6-sulfonic acid, 2-butyl- is C11H14N2O3S.
What is the molecular weight of 1H-Benzimidazole-6-sulfonic acid, 2-butyl-?
The molecular weight of 1H-Benzimidazole-6-sulfonic acid, 2-butyl- is 254.07 g/mol.
Where can I buy 1H-Benzimidazole-6-sulfonic acid, 2-butyl-?
You can request a quote for 1H-Benzimidazole-6-sulfonic acid, 2-butyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Benzimidazole-6-sulfonic acid, 2-butyl-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Benzimidazole-6-sulfonic acid, 2-butyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.