S-(4-Methoxyphenyl) benzenesulfonothioate
TL;DR: S-(4-Methoxyphenyl) benzenesulfonothioate (CAS 1146-48-1) is a chemical compound with molecular formula C13H12O3S2 and molecular weight 280.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(benzenesulfonylsulfanyl)-4-methoxybenzene
Also Known As: S-(4-Methoxyphenyl) benzenesulfonothioate, 1-(benzenesulfonylsulfanyl)-4-methoxybenzene, 1-(benzenesulfonylsulfanyl)-4-methoxy-benzene
| Molecular Formula | C13H12O3S2 |
|---|---|
| Molecular Weight | 280.02 g/mol |
| LogP | 3.1762 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 280.0228 |
| Heavy Atoms | 18 |
| Complexity | 604.44446 |
Chemical Identifiers
| CAS Number | 1146-48-1 |
|---|---|
| SMILES | COC1=CC=C(C=C1)SS(=O)(=O)C2=CC=CC=C2 |
Product Overview
S-(4-Methoxyphenyl) benzenesulfonothioate (CAS 1146-48-1), with molecular formula C13H12O3S2 and molecular weight 280.02 g/mol. IUPAC: 1-(benzenesulfonylsulfanyl)-4-methoxybenzene.
Chemical Property Profile of S-(4-Methoxyphenyl) benzenesulfonothioate
Property Insights of S-(4-Methoxyphenyl) benzenesulfonothioate
The XLogP value of 3.1762 indicates that S-(4-Methoxyphenyl) benzenesulfonothioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.37 Ų, S-(4-Methoxyphenyl) benzenesulfonothioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, S-(4-Methoxyphenyl) benzenesulfonothioate has 0 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 S-(4-Methoxyphenyl) benzenesulfonothioate?
The CAS number of S-(4-Methoxyphenyl) benzenesulfonothioate is 1146-48-1.
What is the molecular formula of S-(4-Methoxyphenyl) benzenesulfonothioate?
The molecular formula of S-(4-Methoxyphenyl) benzenesulfonothioate is C13H12O3S2.
What is the molecular weight of S-(4-Methoxyphenyl) benzenesulfonothioate?
The molecular weight of S-(4-Methoxyphenyl) benzenesulfonothioate is 280.02 g/mol.
Where can I buy S-(4-Methoxyphenyl) benzenesulfonothioate?
You can request a quote for S-(4-Methoxyphenyl) benzenesulfonothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-(4-Methoxyphenyl) benzenesulfonothioate?
Yes, KEHONG BIO provides custom synthesis services for S-(4-Methoxyphenyl) benzenesulfonothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.