1-Benzenesulfonylpyrazole
TL;DR: 1-Benzenesulfonylpyrazole (CAS 108128-27-4) is a chemical compound with molecular formula C9H8N2O2S and molecular weight 208.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(benzenesulfonyl)pyrazole
Also Known As: 1-(Phenylsulfonyl)-1H-pyrazole, 1-(benzenesulfonyl)pyrazole, 1-Benzenesulfonyl-1H-pyrazole, 1-phenylsulfonylpyrazole, 1-BENZENESULFONYLPYRAZOLE
| Molecular Formula | C9H8N2O2S |
|---|---|
| Molecular Weight | 208.03 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 60.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 208.03065 |
| Heavy Atoms | 14 |
| Complexity | 278.0 |
Chemical Identifiers
| CAS Number | 108128-27-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)S(=O)(=O)N2C=CC=N2 |
| InChIKey | ATJIFKKDVQVXKP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Benzenesulfonylpyrazole (CAS 108128-27-4), with molecular formula C9H8N2O2S and molecular weight 208.03 g/mol. IUPAC: 1-(benzenesulfonyl)pyrazole.
Chemical Property Profile of 1-Benzenesulfonylpyrazole
Property Insights of 1-Benzenesulfonylpyrazole
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Benzenesulfonylpyrazole. The TPSA of 60.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Benzenesulfonylpyrazole. Following Lipinski's Rule of Five, 1-Benzenesulfonylpyrazole 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-Benzenesulfonylpyrazole?
The CAS number of 1-Benzenesulfonylpyrazole is 108128-27-4.
What is the molecular formula of 1-Benzenesulfonylpyrazole?
The molecular formula of 1-Benzenesulfonylpyrazole is C9H8N2O2S.
What is the molecular weight of 1-Benzenesulfonylpyrazole?
The molecular weight of 1-Benzenesulfonylpyrazole is 208.03 g/mol.
Where can I buy 1-Benzenesulfonylpyrazole?
You can request a quote for 1-Benzenesulfonylpyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzenesulfonylpyrazole?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzenesulfonylpyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.