![2-[[2-(5-Bromo-2-thienyl)-2-oxoethyl]thio]-1-butyl-1H-benzimidazole-5-sulfonamide structure](/static/products/849/849183-34-2.png)
2-[[2-(5-Bromo-2-thienyl)-2-oxoethyl]thio]-1-butyl-1H-benzimidazole-5-sulfonamide
TL;DR: 2-[[2-(5-Bromo-2-thienyl)-2-oxoethyl]thio]-1-butyl-1H-benzimidazole-5-sulfonamide (CAS 849183-34-2) is a chemical compound with molecular formula C17H18BrN3O3S3 and molecular weight 486.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(5-bromothiophen-2-yl)-2-oxoethyl]sulfanyl-1-butylbenzimidazole-5-sulfonamide
Also Known As: 2-[[2-(5-Bromo-2-thienyl)-2-oxoethyl]thio]-1-butyl-1H-benzimidazole-5-sulfonamide, 2-[2-(5-bromothiophen-2-yl)-2-oxo-ethyl]sulfanyl-1-butyl-benzoimidazole-5-sulfonamide, 2-[2-(5-bromothiophen-2-yl)-2-oxoethyl]sulfanyl-1-butylbenzimidazole-5-sulfonamide, 2-{[2-(5-Bromothiophen-2-yl)-2-oxoethyl]sulfanyl}-1-butyl-1H-benzimidazole-5-sulfonamide
| Molecular Formula | C17H18BrN3O3S3 |
|---|---|
| Molecular Weight | 486.97 g/mol |
| LogP | 4.2828 |
| Topological Polar Surface Area | 95.05 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 486.96936 |
| Heavy Atoms | 27 |
| Complexity | 1089.4774 |
Chemical Identifiers
| CAS Number | 849183-34-2 |
|---|---|
| SMILES | CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)C3=CC=C(S3)Br |
Product Overview
2-[[2-(5-Bromo-2-thienyl)-2-oxoethyl]thio]-1-butyl-1H-benzimidazole-5-sulfonamide (CAS 849183-34-2), with molecular formula C17H18BrN3O3S3 and molecular weight 486.97 g/mol. IUPAC: 2-[2-(5-bromothiophen-2-yl)-2-oxoethyl]sulfanyl-1-butylbenzimidazole-5-sulfonamide.
Chemical Property Profile of 2-[[2-(5-Bromo-2-thienyl)-2-oxoethyl]thio]-1-butyl-1H-benzimidazole-5-sulfonamide
Property Insights of 2-[[2-(5-Bromo-2-thienyl)-2-oxoethyl]thio]-1-butyl-1H-benzimidazole-5-sulfonamide
The XLogP value of 4.2828 indicates that 2-[[2-(5-Bromo-2-thienyl)-2-oxoethyl]thio]-1-butyl-1H-benzimidazole-5-sulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.05 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[[2-(5-Bromo-2-thienyl)-2-oxoethyl]thio]-1-butyl-1H-benzimidazole-5-sulfonamide. Following Lipinski's Rule of Five, 2-[[2-(5-Bromo-2-thienyl)-2-oxoethyl]thio]-1-butyl-1H-benzimidazole-5-sulfonamide has 1 hydrogen bond donor(s) and 6 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-(5-Bromo-2-thienyl)-2-oxoethyl]thio]-1-butyl-1H-benzimidazole-5-sulfonamide?
The CAS number of 2-[[2-(5-Bromo-2-thienyl)-2-oxoethyl]thio]-1-butyl-1H-benzimidazole-5-sulfonamide is 849183-34-2.
What is the molecular formula of 2-[[2-(5-Bromo-2-thienyl)-2-oxoethyl]thio]-1-butyl-1H-benzimidazole-5-sulfonamide?
The molecular formula of 2-[[2-(5-Bromo-2-thienyl)-2-oxoethyl]thio]-1-butyl-1H-benzimidazole-5-sulfonamide is C17H18BrN3O3S3.
What is the molecular weight of 2-[[2-(5-Bromo-2-thienyl)-2-oxoethyl]thio]-1-butyl-1H-benzimidazole-5-sulfonamide?
The molecular weight of 2-[[2-(5-Bromo-2-thienyl)-2-oxoethyl]thio]-1-butyl-1H-benzimidazole-5-sulfonamide is 486.97 g/mol.
Where can I buy 2-[[2-(5-Bromo-2-thienyl)-2-oxoethyl]thio]-1-butyl-1H-benzimidazole-5-sulfonamide?
You can request a quote for 2-[[2-(5-Bromo-2-thienyl)-2-oxoethyl]thio]-1-butyl-1H-benzimidazole-5-sulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[[2-(5-Bromo-2-thienyl)-2-oxoethyl]thio]-1-butyl-1H-benzimidazole-5-sulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[[2-(5-Bromo-2-thienyl)-2-oxoethyl]thio]-1-butyl-1H-benzimidazole-5-sulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.