3J-349S
TL;DR: 3J-349S (CAS 338410-81-4) is a chemical compound with molecular formula C22H19Cl2N3O2S and molecular weight 459.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1-benzyl-5,6-dimethylbenzimidazol-4-yl)-3,5-dichlorobenzenesulfonamide
Also Known As: 3J-349S, N-(1-benzyl-5,6-dimethyl-1H-1,3-benzimidazol-4-yl)-3,5-dichlorobenzenesulfonamide, N-(1-benzyl-5,6-dimethylbenzimidazol-4-yl)-3,5-dichlorobenzenesulfonamide, N-(1-benzyl-5,6-dimethyl-1H-1,3-benzodiazol-4-yl)-3,5-dichlorobenzene-1-sulfonamide
| Molecular Formula | C22H19Cl2N3O2S |
|---|---|
| Molecular Weight | 459.06 g/mol |
| LogP | 5.80904 |
| Topological Polar Surface Area | 63.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 459.0575 |
| Heavy Atoms | 30 |
| Complexity | 1329.823 |
Chemical Identifiers
| CAS Number | 338410-81-4 |
|---|---|
| SMILES | CC1=CC2=C(C(=C1C)NS(=O)(=O)C3=CC(=CC(=C3)Cl)Cl)N=CN2CC4=CC=CC=C4 |
Product Overview
3J-349S (CAS 338410-81-4), with molecular formula C22H19Cl2N3O2S and molecular weight 459.06 g/mol. IUPAC: N-(1-benzyl-5,6-dimethylbenzimidazol-4-yl)-3,5-dichlorobenzenesulfonamide.
Chemical Property Profile of 3J-349S
Property Insights of 3J-349S
The XLogP value of 5.80904 indicates that 3J-349S 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 3J-349S. Following Lipinski's Rule of Five, 3J-349S 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 3J-349S?
The CAS number of 3J-349S is 338410-81-4.
What is the molecular formula of 3J-349S?
The molecular formula of 3J-349S is C22H19Cl2N3O2S.
What is the molecular weight of 3J-349S?
The molecular weight of 3J-349S is 459.06 g/mol.
Where can I buy 3J-349S?
You can request a quote for 3J-349S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3J-349S?
Yes, KEHONG BIO provides custom synthesis services for 3J-349S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.