8J-333S
TL;DR: 8J-333S (CAS 339100-71-9) is a chemical compound with molecular formula C23H21N3O2S and molecular weight 403.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-methoxyphenyl)-2-[2-(phenylsulfanylmethyl)benzimidazol-1-yl]acetamide
Also Known As: 8J-333S, N-(4-Methoxyphenyl)-2-(2-((phenylsulfanyl)methyl)-1H-1,3-benzimidazol-1-yl)acetamide, N-(4-methoxyphenyl)-2-[2-(phenylsulfanylmethyl)benzimidazol-1-yl]acetamide, N-(4-methoxyphenyl)-2-{2-[(phenylsulfanyl)methyl]-1H-1,3-benzimidazol-1-yl}acetamide, N-(4-methoxyphenyl)-2-{2-[(phenylsulfanyl)methyl]-1H-1,3-benzodiazol-1-yl}acetamide
| Molecular Formula | C23H21N3O2S |
|---|---|
| Molecular Weight | 403.14 g/mol |
| LogP | 4.9759 |
| Topological Polar Surface Area | 56.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 403.13544 |
| Heavy Atoms | 29 |
| Complexity | 1108.1481 |
Chemical Identifiers
| CAS Number | 339100-71-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC(=O)CN2C3=CC=CC=C3N=C2CSC4=CC=CC=C4 |
Product Overview
8J-333S (CAS 339100-71-9), with molecular formula C23H21N3O2S and molecular weight 403.14 g/mol. IUPAC: N-(4-methoxyphenyl)-2-[2-(phenylsulfanylmethyl)benzimidazol-1-yl]acetamide.
Chemical Property Profile of 8J-333S
Property Insights of 8J-333S
The XLogP value of 4.9759 indicates that 8J-333S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.15 Ų, 8J-333S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8J-333S 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-333S?
The CAS number of 8J-333S is 339100-71-9.
What is the molecular formula of 8J-333S?
The molecular formula of 8J-333S is C23H21N3O2S.
What is the molecular weight of 8J-333S?
The molecular weight of 8J-333S is 403.14 g/mol.
Where can I buy 8J-333S?
You can request a quote for 8J-333S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8J-333S?
Yes, KEHONG BIO provides custom synthesis services for 8J-333S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.