8J-336S
TL;DR: 8J-336S (CAS 339100-80-0) is a chemical compound with molecular formula C23H21N3O3S and molecular weight 419.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(benzenesulfinylmethyl)benzimidazol-1-yl]-N-(4-methoxyphenyl)acetamide
Also Known As: 8J-336S, N-(4-Methoxyphenyl)-2-(2-((phenylsulfinyl)methyl)-1H-1,3-benzimidazol-1-yl)acetamide, 2-[2-(benzenesulfinylmethyl)benzimidazol-1-yl]-N-(4-methoxyphenyl)acetamide, 2-[2-(benzenesulfinylmethyl)benzoimidazol-1-yl]-N-(4-methoxyphenyl)acetamide, 2-{2-[(benzenesulfinyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-(4-methoxyphenyl)acetamide
| Molecular Formula | C23H21N3O3S |
|---|---|
| Molecular Weight | 419.13 g/mol |
| LogP | 3.9914 |
| Topological Polar Surface Area | 73.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 419.13037 |
| Heavy Atoms | 30 |
| Complexity | 1187.5353 |
Chemical Identifiers
| CAS Number | 339100-80-0 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC(=O)CN2C3=CC=CC=C3N=C2CS(=O)C4=CC=CC=C4 |
Product Overview
8J-336S (CAS 339100-80-0), with molecular formula C23H21N3O3S and molecular weight 419.13 g/mol. IUPAC: 2-[2-(benzenesulfinylmethyl)benzimidazol-1-yl]-N-(4-methoxyphenyl)acetamide.
Chemical Property Profile of 8J-336S
Property Insights of 8J-336S
The XLogP value of 3.9914 indicates that 8J-336S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.22 Ų falls within the moderate polarity range, balancing permeability and solubility for 8J-336S. Following Lipinski's Rule of Five, 8J-336S has 1 hydrogen bond donor(s) and 4 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 8J-336S?
The CAS number of 8J-336S is 339100-80-0.
What is the molecular formula of 8J-336S?
The molecular formula of 8J-336S is C23H21N3O3S.
What is the molecular weight of 8J-336S?
The molecular weight of 8J-336S is 419.13 g/mol.
Where can I buy 8J-336S?
You can request a quote for 8J-336S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8J-336S?
Yes, KEHONG BIO provides custom synthesis services for 8J-336S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.