4-Methyl-3-(phenylsulfonyl)furoxan
TL;DR: 4-Methyl-3-(phenylsulfonyl)furoxan (CAS 5448-00-0) is a chemical compound with molecular formula C9H8N2O4S and molecular weight 240.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(benzenesulfonyl)-4-methyl-2-oxido-1,2,5-oxadiazol-2-ium
Also Known As: 4-Mpsf, S35b, 4-Methyl-3-(phenylsulfonyl)furoxan, S 35b, S-35b
| Molecular Formula | C9H8N2O4S |
|---|---|
| Molecular Weight | 240.02 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 94.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 240.02048 |
| Heavy Atoms | 16 |
| Complexity | 334.0 |
Chemical Identifiers
| CAS Number | 5448-00-0 |
|---|---|
| SMILES | CC1=NO[N+](=C1S(=O)(=O)C2=CC=CC=C2)[O-] |
| InChIKey | DCHTVANWMDHNOB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Methyl-3-(phenylsulfonyl)furoxan (CAS 5448-00-0), with molecular formula C9H8N2O4S and molecular weight 240.02 g/mol. IUPAC: 3-(benzenesulfonyl)-4-methyl-2-oxido-1,2,5-oxadiazol-2-ium.
Chemical Property Profile of 4-Methyl-3-(phenylsulfonyl)furoxan
Property Insights of 4-Methyl-3-(phenylsulfonyl)furoxan
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methyl-3-(phenylsulfonyl)furoxan. The TPSA of 94.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Methyl-3-(phenylsulfonyl)furoxan. Following Lipinski's Rule of Five, 4-Methyl-3-(phenylsulfonyl)furoxan has 0 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-Methyl-3-(phenylsulfonyl)furoxan?
The CAS number of 4-Methyl-3-(phenylsulfonyl)furoxan is 5448-00-0.
What is the molecular formula of 4-Methyl-3-(phenylsulfonyl)furoxan?
The molecular formula of 4-Methyl-3-(phenylsulfonyl)furoxan is C9H8N2O4S.
What is the molecular weight of 4-Methyl-3-(phenylsulfonyl)furoxan?
The molecular weight of 4-Methyl-3-(phenylsulfonyl)furoxan is 240.02 g/mol.
Where can I buy 4-Methyl-3-(phenylsulfonyl)furoxan?
You can request a quote for 4-Methyl-3-(phenylsulfonyl)furoxan directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methyl-3-(phenylsulfonyl)furoxan?
Yes, KEHONG BIO provides custom synthesis services for 4-Methyl-3-(phenylsulfonyl)furoxan and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.