4J-506S
TL;DR: 4J-506S (CAS 338423-84-0) is a chemical compound with molecular formula C22H13Cl3O3S and molecular weight 461.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-chlorophenyl)-[3-[(2,4-dichlorophenyl)sulfinylmethyl]-1-benzofuran-2-yl]methanone
Also Known As: 4J-506S, (4-chlorophenyl)(3-{[(2,4-dichlorophenyl)sulfinyl]methyl}-1-benzofuran-2-yl)methanone, 2-(4-chlorobenzoyl)-3-[(2,4-dichlorobenzenesulfinyl)methyl]-1-benzofuran, (4-chlorophenyl)-[3-[(2,4-dichlorophenyl)sulfinylmethyl]-1-benzofuran-2-yl]methanone, (4-chlorophenyl)-[3-[(2,4-dichlorophenyl)sulfinylmethyl]benzofuran-2-yl]methanone
| Molecular Formula | C22H13Cl3O3S |
|---|---|
| Molecular Weight | 461.97 g/mol |
| LogP | 6.9318 |
| Topological Polar Surface Area | 47.28 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 461.9651 |
| Heavy Atoms | 29 |
| Complexity | 1246.1399 |
Chemical Identifiers
| CAS Number | 338423-84-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=C(O2)C(=O)C3=CC=C(C=C3)Cl)CS(=O)C4=C(C=C(C=C4)Cl)Cl |
Product Overview
4J-506S (CAS 338423-84-0), with molecular formula C22H13Cl3O3S and molecular weight 461.97 g/mol. IUPAC: (4-chlorophenyl)-[3-[(2,4-dichlorophenyl)sulfinylmethyl]-1-benzofuran-2-yl]methanone.
Chemical Property Profile of 4J-506S
Property Insights of 4J-506S
The XLogP value of 6.9318 indicates that 4J-506S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.28 Ų, 4J-506S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4J-506S has 0 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-506S?
The CAS number of 4J-506S is 338423-84-0.
What is the molecular formula of 4J-506S?
The molecular formula of 4J-506S is C22H13Cl3O3S.
What is the molecular weight of 4J-506S?
The molecular weight of 4J-506S is 461.97 g/mol.
Where can I buy 4J-506S?
You can request a quote for 4J-506S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4J-506S?
Yes, KEHONG BIO provides custom synthesis services for 4J-506S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.