(4-Methylphenyl)sulfonylmethanesulfonamide
TL;DR: (4-Methylphenyl)sulfonylmethanesulfonamide (CAS 55116-69-3) is a chemical compound with molecular formula C8H11NO4S2 and molecular weight 249.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-methylphenyl)sulfonylmethanesulfonamide
Also Known As: (4-methylphenyl)sulfonylmethanesulfonamide, 1-(4-Methylbenzene-1-sulfonyl)methanesulfonamide
| Molecular Formula | C8H11NO4S2 |
|---|---|
| Molecular Weight | 249.01 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 111.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 249.01295 |
| Heavy Atoms | 15 |
| Complexity | 393.0 |
Chemical Identifiers
| CAS Number | 55116-69-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)CS(=O)(=O)N |
| InChIKey | SCFXUXTYBAOHAV-UHFFFAOYSA-N |
Product Overview
(4-Methylphenyl)sulfonylmethanesulfonamide (CAS 55116-69-3), with molecular formula C8H11NO4S2 and molecular weight 249.01 g/mol. IUPAC: (4-methylphenyl)sulfonylmethanesulfonamide.
Chemical Property Profile of (4-Methylphenyl)sulfonylmethanesulfonamide
Property Insights of (4-Methylphenyl)sulfonylmethanesulfonamide
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-Methylphenyl)sulfonylmethanesulfonamide. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-Methylphenyl)sulfonylmethanesulfonamide. Following Lipinski's Rule of Five, (4-Methylphenyl)sulfonylmethanesulfonamide has 1 hydrogen bond donor(s) and 5 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 (4-Methylphenyl)sulfonylmethanesulfonamide?
The CAS number of (4-Methylphenyl)sulfonylmethanesulfonamide is 55116-69-3.
What is the molecular formula of (4-Methylphenyl)sulfonylmethanesulfonamide?
The molecular formula of (4-Methylphenyl)sulfonylmethanesulfonamide is C8H11NO4S2.
What is the molecular weight of (4-Methylphenyl)sulfonylmethanesulfonamide?
The molecular weight of (4-Methylphenyl)sulfonylmethanesulfonamide is 249.01 g/mol.
Where can I buy (4-Methylphenyl)sulfonylmethanesulfonamide?
You can request a quote for (4-Methylphenyl)sulfonylmethanesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Methylphenyl)sulfonylmethanesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for (4-Methylphenyl)sulfonylmethanesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.