S-(Bis((4-methylphenyl)sulfonyl)methyl) 4-methylbenzenesulfonothioate
TL;DR: S-(Bis((4-methylphenyl)sulfonyl)methyl) 4-methylbenzenesulfonothioate (CAS 75195-73-2) is a chemical compound with molecular formula C22H22O6S4 and molecular weight 510.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-4-[(4-methylphenyl)sulfonyl-(4-methylphenyl)sulfonylsulfanylmethyl]sulfonylbenzene
Also Known As: S-(Bis((4-methylphenyl)sulfonyl)methyl) 4-methylbenzenesulfonothioate, 1-methyl-4-[(4-methylphenyl)sulfonyl-(4-methylphenyl)sulfony, 1-methyl-4-[(4-methylphenyl)sulfonyl-(4-methylphenyl)sulfonylsulfanylmethyl]sulfonylbenzene, Benzenesulfonothioicacid, 4-methyl-, S-[bis[(4-methylphenyl)sulfonyl]methyl] ester, 1-methyl-4-[p-tolylsulfonyl(p-tolylsulfonylsulfanyl)methyl]sulfonyl-benzene
| Molecular Formula | C22H22O6S4 |
|---|---|
| Molecular Weight | 510.03 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 153.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 510.02994 |
| Heavy Atoms | 32 |
| Complexity | 864.0 |
Chemical Identifiers
| CAS Number | 75195-73-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)C(SS(=O)(=O)C2=CC=C(C=C2)C)S(=O)(=O)C3=CC=C(C=C3)C |
| InChIKey | YDWSRJKLEWDJCL-UHFFFAOYSA-N |
Product Overview
S-(Bis((4-methylphenyl)sulfonyl)methyl) 4-methylbenzenesulfonothioate (CAS 75195-73-2), with molecular formula C22H22O6S4 and molecular weight 510.03 g/mol. IUPAC: 1-methyl-4-[(4-methylphenyl)sulfonyl-(4-methylphenyl)sulfonylsulfanylmethyl]sulfonylbenzene.
Chemical Property Profile of S-(Bis((4-methylphenyl)sulfonyl)methyl) 4-methylbenzenesulfonothioate
Property Insights of S-(Bis((4-methylphenyl)sulfonyl)methyl) 4-methylbenzenesulfonothioate
The XLogP value of 4.8 indicates that S-(Bis((4-methylphenyl)sulfonyl)methyl) 4-methylbenzenesulfonothioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 153.0 Ų indicates high polarity, suggesting S-(Bis((4-methylphenyl)sulfonyl)methyl) 4-methylbenzenesulfonothioate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, S-(Bis((4-methylphenyl)sulfonyl)methyl) 4-methylbenzenesulfonothioate has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of S-(Bis((4-methylphenyl)sulfonyl)methyl) 4-methylbenzenesulfonothioate?
The CAS number of S-(Bis((4-methylphenyl)sulfonyl)methyl) 4-methylbenzenesulfonothioate is 75195-73-2.
What is the molecular formula of S-(Bis((4-methylphenyl)sulfonyl)methyl) 4-methylbenzenesulfonothioate?
The molecular formula of S-(Bis((4-methylphenyl)sulfonyl)methyl) 4-methylbenzenesulfonothioate is C22H22O6S4.
What is the molecular weight of S-(Bis((4-methylphenyl)sulfonyl)methyl) 4-methylbenzenesulfonothioate?
The molecular weight of S-(Bis((4-methylphenyl)sulfonyl)methyl) 4-methylbenzenesulfonothioate is 510.03 g/mol.
Where can I buy S-(Bis((4-methylphenyl)sulfonyl)methyl) 4-methylbenzenesulfonothioate?
You can request a quote for S-(Bis((4-methylphenyl)sulfonyl)methyl) 4-methylbenzenesulfonothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-(Bis((4-methylphenyl)sulfonyl)methyl) 4-methylbenzenesulfonothioate?
Yes, KEHONG BIO provides custom synthesis services for S-(Bis((4-methylphenyl)sulfonyl)methyl) 4-methylbenzenesulfonothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.