1-Tosylpyrozole
TL;DR: 1-Tosylpyrozole (CAS 6126-10-9) is a chemical compound with molecular formula C10H10N2O2S and molecular weight 222.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methylphenyl)sulfonylpyrazole
Also Known As: 1-Tosylpyrozole, 1-Tosyl-1H-pyrazole, 1-TOSYLPYRAZOLE, 1-Tosylpyrazol, METHYLCAFFEATE
| Molecular Formula | C10H10N2O2S |
|---|---|
| Molecular Weight | 222.05 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 60.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 222.0463 |
| Heavy Atoms | 15 |
| Complexity | 302.0 |
Chemical Identifiers
| CAS Number | 6126-10-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N2C=CC=N2 |
| InChIKey | XDFZXGSBGXAPLS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Tosylpyrozole (CAS 6126-10-9), with molecular formula C10H10N2O2S and molecular weight 222.05 g/mol. IUPAC: 1-(4-methylphenyl)sulfonylpyrazole.
Chemical Property Profile of 1-Tosylpyrozole
Property Insights of 1-Tosylpyrozole
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Tosylpyrozole. The TPSA of 60.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Tosylpyrozole. Following Lipinski's Rule of Five, 1-Tosylpyrozole 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-Tosylpyrozole?
The CAS number of 1-Tosylpyrozole is 6126-10-9.
What is the molecular formula of 1-Tosylpyrozole?
The molecular formula of 1-Tosylpyrozole is C10H10N2O2S.
What is the molecular weight of 1-Tosylpyrozole?
The molecular weight of 1-Tosylpyrozole is 222.05 g/mol.
Where can I buy 1-Tosylpyrozole?
You can request a quote for 1-Tosylpyrozole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Tosylpyrozole?
Yes, KEHONG BIO provides custom synthesis services for 1-Tosylpyrozole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.