4J-389S
TL;DR: 4J-389S (CAS 865660-72-6) is a chemical compound with molecular formula C23H20Cl3N3O2S and molecular weight 507.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4,6-trichloro-N-[5,6-dimethyl-1-[(3-methylphenyl)methyl]benzimidazol-4-yl]benzenesulfonamide
Also Known As: 4J-389S, 2,4,6-trichloro-N-[5,6-dimethyl-1-(3-methylbenzyl)-1H-1,3-benzimidazol-4-yl]benzenesulfonamide, 2,4,6-trichloro-N-[5,6-dimethyl-1-[(3-methylphenyl)methyl]benzimidazol-4-yl]benzenesulfonamide, 2,4,6-trichloro-N-{5,6-dimethyl-1-[(3-methylphenyl)methyl]-1H-1,3-benzodiazol-4-yl}benzene-1-sulfonamide, 2,4,6-trichloro-N-[5,6-dimethyl-1-[(3-methylphenyl)methyl]benzoimidazol-4-yl]benzenesulfonamide
| Molecular Formula | C23H20Cl3N3O2S |
|---|---|
| Molecular Weight | 507.03 g/mol |
| LogP | 6.77086 |
| Topological Polar Surface Area | 63.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 507.03418 |
| Heavy Atoms | 32 |
| Complexity | 1440.1158 |
Chemical Identifiers
| CAS Number | 865660-72-6 |
|---|---|
| SMILES | CC1=CC(=CC=C1)CN2C=NC3=C2C=C(C(=C3NS(=O)(=O)C4=C(C=C(C=C4Cl)Cl)Cl)C)C |
Product Overview
4J-389S (CAS 865660-72-6), with molecular formula C23H20Cl3N3O2S and molecular weight 507.03 g/mol. IUPAC: 2,4,6-trichloro-N-[5,6-dimethyl-1-[(3-methylphenyl)methyl]benzimidazol-4-yl]benzenesulfonamide.
Chemical Property Profile of 4J-389S
Property Insights of 4J-389S
The XLogP value of 6.77086 indicates that 4J-389S 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-389S. Following Lipinski's Rule of Five, 4J-389S 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-389S?
The CAS number of 4J-389S is 865660-72-6.
What is the molecular formula of 4J-389S?
The molecular formula of 4J-389S is C23H20Cl3N3O2S.
What is the molecular weight of 4J-389S?
The molecular weight of 4J-389S is 507.03 g/mol.
Where can I buy 4J-389S?
You can request a quote for 4J-389S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4J-389S?
Yes, KEHONG BIO provides custom synthesis services for 4J-389S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.