8J-345S
TL;DR: 8J-345S (CAS 339100-96-8) is a chemical compound with molecular formula C24H22ClN3OS and molecular weight 435.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[(4-chlorophenyl)sulfanylmethyl]benzimidazol-1-yl]-N-(2,6-dimethylphenyl)acetamide
Also Known As: 8J-345S, 2-(2-{[(4-chlorophenyl)sulfanyl]methyl}-1H-1,3-benzimidazol-1-yl)-N-(2,6-dimethylphenyl)acetamide, 2-[2-[(4-chlorophenyl)sulfanylmethyl]benzimidazol-1-yl]-N-(2,6-dimethylphenyl)acetamide, 2-[2-[(4-chlorophenyl)sulfanylmethyl]benzoimidazol-1-yl]-N-(2,6-dimethylphenyl)acetamide, 2-(2-(((4-Chlorophenyl)sulfanyl)methyl)-1H-1,3-benzimidazol-1-yl)-N-(2,6-dichlorophenyl)acetamide
| Molecular Formula | C24H22ClN3OS |
|---|---|
| Molecular Weight | 435.12 g/mol |
| LogP | 6.23754 |
| Topological Polar Surface Area | 46.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 435.11722 |
| Heavy Atoms | 30 |
| Complexity | 1180.7832 |
Chemical Identifiers
| CAS Number | 339100-96-8 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C)NC(=O)CN2C3=CC=CC=C3N=C2CSC4=CC=C(C=C4)Cl |
Product Overview
8J-345S (CAS 339100-96-8), with molecular formula C24H22ClN3OS and molecular weight 435.12 g/mol. IUPAC: 2-[2-[(4-chlorophenyl)sulfanylmethyl]benzimidazol-1-yl]-N-(2,6-dimethylphenyl)acetamide.
Chemical Property Profile of 8J-345S
Property Insights of 8J-345S
The XLogP value of 6.23754 indicates that 8J-345S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.92 Ų, 8J-345S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8J-345S 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 8J-345S?
The CAS number of 8J-345S is 339100-96-8.
What is the molecular formula of 8J-345S?
The molecular formula of 8J-345S is C24H22ClN3OS.
What is the molecular weight of 8J-345S?
The molecular weight of 8J-345S is 435.12 g/mol.
Where can I buy 8J-345S?
You can request a quote for 8J-345S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8J-345S?
Yes, KEHONG BIO provides custom synthesis services for 8J-345S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.