![5-[4-(methylsulfonyl)phenyl]-2H-tetrazole structure](/static/products/1968/196803-72-2.webp)
5-[4-(methylsulfonyl)phenyl]-2H-tetrazole
TL;DR: 5-[4-(methylsulfonyl)phenyl]-2H-tetrazole (CAS 196803-72-2) is a chemical compound with molecular formula C8H8N4O2S and molecular weight 224.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-methylsulfonylphenyl)-2H-tetrazole
Also Known As: 5-[4-(methylsulfonyl)phenyl]-2H-tetrazole, 2-Ethoxyphenethylamine, 5-(4-methylsulfonylphenyl)-2H-tetrazole, BAS 05512174, 5-(4-(Methylsulfonyl)phenyl)-2H-tetrazole
| Molecular Formula | C8H8N4O2S |
|---|---|
| Molecular Weight | 224.04 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 97.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 224.0368 |
| Heavy Atoms | 15 |
| Complexity | 305.0 |
Chemical Identifiers
| CAS Number | 196803-72-2 |
|---|---|
| SMILES | CS(=O)(=O)C1=CC=C(C=C1)C2=NNN=N2 |
| InChIKey | QNQGKDWSIRANDF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-[4-(methylsulfonyl)phenyl]-2H-tetrazole (CAS 196803-72-2), with molecular formula C8H8N4O2S and molecular weight 224.04 g/mol. IUPAC: 5-(4-methylsulfonylphenyl)-2H-tetrazole.
Chemical Property Profile of 5-[4-(methylsulfonyl)phenyl]-2H-tetrazole
Property Insights of 5-[4-(methylsulfonyl)phenyl]-2H-tetrazole
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[4-(methylsulfonyl)phenyl]-2H-tetrazole. The TPSA of 97.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[4-(methylsulfonyl)phenyl]-2H-tetrazole. Following Lipinski's Rule of Five, 5-[4-(methylsulfonyl)phenyl]-2H-tetrazole 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 5-[4-(methylsulfonyl)phenyl]-2H-tetrazole?
The CAS number of 5-[4-(methylsulfonyl)phenyl]-2H-tetrazole is 196803-72-2.
What is the molecular formula of 5-[4-(methylsulfonyl)phenyl]-2H-tetrazole?
The molecular formula of 5-[4-(methylsulfonyl)phenyl]-2H-tetrazole is C8H8N4O2S.
What is the molecular weight of 5-[4-(methylsulfonyl)phenyl]-2H-tetrazole?
The molecular weight of 5-[4-(methylsulfonyl)phenyl]-2H-tetrazole is 224.04 g/mol.
Where can I buy 5-[4-(methylsulfonyl)phenyl]-2H-tetrazole?
You can request a quote for 5-[4-(methylsulfonyl)phenyl]-2H-tetrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[4-(methylsulfonyl)phenyl]-2H-tetrazole?
Yes, KEHONG BIO provides custom synthesis services for 5-[4-(methylsulfonyl)phenyl]-2H-tetrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.