![1-Methyl-4-({[(4-methylphenyl)sulfanyl]methyl}sulfonyl)benzene structure](/static/products/5868/58680-49-2.webp)
1-Methyl-4-({[(4-methylphenyl)sulfanyl]methyl}sulfonyl)benzene
TL;DR: 1-Methyl-4-({[(4-methylphenyl)sulfanyl]methyl}sulfonyl)benzene (CAS 58680-49-2) is a chemical compound with molecular formula C15H16O2S2 and molecular weight 292.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-4-[(4-methylphenyl)sulfonylmethylsulfanyl]benzene
Also Known As: 1-methyl-4-({[(4-methylphenyl)sulfanyl]methyl}sulfonyl)benzene, 1-methyl-4-[(4-methylphenyl)sulfonylmethylsulfanyl]benzene
| Molecular Formula | C15H16O2S2 |
|---|---|
| Molecular Weight | 292.06 g/mol |
| LogP | 3.82694 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 292.05917 |
| Heavy Atoms | 19 |
| Complexity | 641.54987 |
Chemical Identifiers
| CAS Number | 58680-49-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)SCS(=O)(=O)C2=CC=C(C=C2)C |
Product Overview
1-Methyl-4-({[(4-methylphenyl)sulfanyl]methyl}sulfonyl)benzene (CAS 58680-49-2), with molecular formula C15H16O2S2 and molecular weight 292.06 g/mol. IUPAC: 1-methyl-4-[(4-methylphenyl)sulfonylmethylsulfanyl]benzene.
Chemical Property Profile of 1-Methyl-4-({[(4-methylphenyl)sulfanyl]methyl}sulfonyl)benzene
Property Insights of 1-Methyl-4-({[(4-methylphenyl)sulfanyl]methyl}sulfonyl)benzene
The XLogP value of 3.82694 indicates that 1-Methyl-4-({[(4-methylphenyl)sulfanyl]methyl}sulfonyl)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.14 Ų, 1-Methyl-4-({[(4-methylphenyl)sulfanyl]methyl}sulfonyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methyl-4-({[(4-methylphenyl)sulfanyl]methyl}sulfonyl)benzene has 0 hydrogen bond donor(s) and 3 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 1-Methyl-4-({[(4-methylphenyl)sulfanyl]methyl}sulfonyl)benzene?
The CAS number of 1-Methyl-4-({[(4-methylphenyl)sulfanyl]methyl}sulfonyl)benzene is 58680-49-2.
What is the molecular formula of 1-Methyl-4-({[(4-methylphenyl)sulfanyl]methyl}sulfonyl)benzene?
The molecular formula of 1-Methyl-4-({[(4-methylphenyl)sulfanyl]methyl}sulfonyl)benzene is C15H16O2S2.
What is the molecular weight of 1-Methyl-4-({[(4-methylphenyl)sulfanyl]methyl}sulfonyl)benzene?
The molecular weight of 1-Methyl-4-({[(4-methylphenyl)sulfanyl]methyl}sulfonyl)benzene is 292.06 g/mol.
Where can I buy 1-Methyl-4-({[(4-methylphenyl)sulfanyl]methyl}sulfonyl)benzene?
You can request a quote for 1-Methyl-4-({[(4-methylphenyl)sulfanyl]methyl}sulfonyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-4-({[(4-methylphenyl)sulfanyl]methyl}sulfonyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-4-({[(4-methylphenyl)sulfanyl]methyl}sulfonyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.