![2-Benzylsulfonyl-1-[(4-chlorophenyl)methyl]benzimidazole structure](/static/products/5545/5545-72-2.webp)
2-Benzylsulfonyl-1-[(4-chlorophenyl)methyl]benzimidazole
TL;DR: 2-Benzylsulfonyl-1-[(4-chlorophenyl)methyl]benzimidazole (CAS 5545-72-2) is a chemical compound with molecular formula C21H17ClN2O2S and molecular weight 396.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzylsulfonyl-1-[(4-chlorophenyl)methyl]benzimidazole
Also Known As: BAS 00633541, BIM-0023670.P001, 2-(benzylsulfonyl)-1-(4-chlorobenzyl)-1H-benzimidazole, 2-benzylsulfonyl-1-[(4-chlorophenyl)methyl]benzimidazole, 1-[(4-chlorophenyl)methyl]-2-[benzylsulfonyl]benzimidazole
| Molecular Formula | C21H17ClN2O2S |
|---|---|
| Molecular Weight | 396.07 g/mol |
| LogP | 4.7119 |
| Topological Polar Surface Area | 51.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 396.06992 |
| Heavy Atoms | 27 |
| Complexity | 1184.0789 |
Chemical Identifiers
| CAS Number | 5545-72-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)CS(=O)(=O)C2=NC3=CC=CC=C3N2CC4=CC=C(C=C4)Cl |
Product Overview
2-Benzylsulfonyl-1-[(4-chlorophenyl)methyl]benzimidazole (CAS 5545-72-2), with molecular formula C21H17ClN2O2S and molecular weight 396.07 g/mol. IUPAC: 2-benzylsulfonyl-1-[(4-chlorophenyl)methyl]benzimidazole.
Chemical Property Profile of 2-Benzylsulfonyl-1-[(4-chlorophenyl)methyl]benzimidazole
Property Insights of 2-Benzylsulfonyl-1-[(4-chlorophenyl)methyl]benzimidazole
The XLogP value of 4.7119 indicates that 2-Benzylsulfonyl-1-[(4-chlorophenyl)methyl]benzimidazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.96 Ų, 2-Benzylsulfonyl-1-[(4-chlorophenyl)methyl]benzimidazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Benzylsulfonyl-1-[(4-chlorophenyl)methyl]benzimidazole has 0 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 2-Benzylsulfonyl-1-[(4-chlorophenyl)methyl]benzimidazole?
The CAS number of 2-Benzylsulfonyl-1-[(4-chlorophenyl)methyl]benzimidazole is 5545-72-2.
What is the molecular formula of 2-Benzylsulfonyl-1-[(4-chlorophenyl)methyl]benzimidazole?
The molecular formula of 2-Benzylsulfonyl-1-[(4-chlorophenyl)methyl]benzimidazole is C21H17ClN2O2S.
What is the molecular weight of 2-Benzylsulfonyl-1-[(4-chlorophenyl)methyl]benzimidazole?
The molecular weight of 2-Benzylsulfonyl-1-[(4-chlorophenyl)methyl]benzimidazole is 396.07 g/mol.
Where can I buy 2-Benzylsulfonyl-1-[(4-chlorophenyl)methyl]benzimidazole?
You can request a quote for 2-Benzylsulfonyl-1-[(4-chlorophenyl)methyl]benzimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Benzylsulfonyl-1-[(4-chlorophenyl)methyl]benzimidazole?
Yes, KEHONG BIO provides custom synthesis services for 2-Benzylsulfonyl-1-[(4-chlorophenyl)methyl]benzimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.