4J-391S
TL;DR: 4J-391S (CAS 338423-61-3) is a chemical compound with molecular formula C23H22ClN3O2S and molecular weight 439.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-[5,6-dimethyl-1-[(3-methylphenyl)methyl]benzimidazol-4-yl]benzenesulfonamide
Also Known As: 4J-391S, 4-chloro-N-[5,6-dimethyl-1-(3-methylbenzyl)-1H-1,3-benzimidazol-4-yl]benzenesulfonamide, 4-chloro-N-[5,6-dimethyl-1-[(3-methylphenyl)methyl]benzimidazol-4-yl]benzenesulfonamide, 4-chloro-N-{5,6-dimethyl-1-[(3-methylphenyl)methyl]-1H-1,3-benzodiazol-4-yl}benzene-1-sulfonamide
| Molecular Formula | C23H22ClN3O2S |
|---|---|
| Molecular Weight | 439.11 g/mol |
| LogP | 5.46406 |
| Topological Polar Surface Area | 63.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 439.11212 |
| Heavy Atoms | 30 |
| Complexity | 1343.1385 |
Chemical Identifiers
| CAS Number | 338423-61-3 |
|---|---|
| SMILES | CC1=CC(=CC=C1)CN2C=NC3=C2C=C(C(=C3NS(=O)(=O)C4=CC=C(C=C4)Cl)C)C |
Product Overview
4J-391S (CAS 338423-61-3), with molecular formula C23H22ClN3O2S and molecular weight 439.11 g/mol. IUPAC: 4-chloro-N-[5,6-dimethyl-1-[(3-methylphenyl)methyl]benzimidazol-4-yl]benzenesulfonamide.
Chemical Property Profile of 4J-391S
Property Insights of 4J-391S
The XLogP value of 5.46406 indicates that 4J-391S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.99 Ų falls within the moderate polarity range, balancing permeability and solubility for 4J-391S. Following Lipinski's Rule of Five, 4J-391S has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4J-391S?
The CAS number of 4J-391S is 338423-61-3.
What is the molecular formula of 4J-391S?
The molecular formula of 4J-391S is C23H22ClN3O2S.
What is the molecular weight of 4J-391S?
The molecular weight of 4J-391S is 439.11 g/mol.
Where can I buy 4J-391S?
You can request a quote for 4J-391S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4J-391S?
Yes, KEHONG BIO provides custom synthesis services for 4J-391S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.