4-Bromo-1-(2,5-difluorophenyl)sulfonylpyrazole
TL;DR: 4-Bromo-1-(2,5-difluorophenyl)sulfonylpyrazole (CAS 957490-66-3) is a chemical compound with molecular formula C9H5BrF2N2O2S and molecular weight 321.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-1-(2,5-difluorophenyl)sulfonylpyrazole
Also Known As: 4-bromo-1-(2,5-difluorophenyl)sulfonylpyrazole, 1-[(2,5-difluorophenyl)sulfonyl]-4-bromopyrazole, 4-bromo-1-[(2,5-difluorophenyl)sulfonyl]-1H-pyrazole, 4-BROMO-1H-PYRAZOL-1-YL (2,5-DIFLUOROPHENYL) SULFONE
| Molecular Formula | C9H5BrF2N2O2S |
|---|---|
| Molecular Weight | 321.92 g/mol |
| LogP | 2.1608 |
| Topological Polar Surface Area | 51.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 321.92233 |
| Heavy Atoms | 17 |
| Complexity | 669.38544 |
Chemical Identifiers
| CAS Number | 957490-66-3 |
|---|---|
| SMILES | C1=CC(=C(C=C1F)S(=O)(=O)N2C=C(C=N2)Br)F |
Product Overview
4-Bromo-1-(2,5-difluorophenyl)sulfonylpyrazole (CAS 957490-66-3), with molecular formula C9H5BrF2N2O2S and molecular weight 321.92 g/mol. IUPAC: 4-bromo-1-(2,5-difluorophenyl)sulfonylpyrazole.
Chemical Property Profile of 4-Bromo-1-(2,5-difluorophenyl)sulfonylpyrazole
Property Insights of 4-Bromo-1-(2,5-difluorophenyl)sulfonylpyrazole
The XLogP value of 2.1608 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Bromo-1-(2,5-difluorophenyl)sulfonylpyrazole. With a topological polar surface area (TPSA) of 51.96 Ų, 4-Bromo-1-(2,5-difluorophenyl)sulfonylpyrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromo-1-(2,5-difluorophenyl)sulfonylpyrazole 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 4-Bromo-1-(2,5-difluorophenyl)sulfonylpyrazole?
The CAS number of 4-Bromo-1-(2,5-difluorophenyl)sulfonylpyrazole is 957490-66-3.
What is the molecular formula of 4-Bromo-1-(2,5-difluorophenyl)sulfonylpyrazole?
The molecular formula of 4-Bromo-1-(2,5-difluorophenyl)sulfonylpyrazole is C9H5BrF2N2O2S.
What is the molecular weight of 4-Bromo-1-(2,5-difluorophenyl)sulfonylpyrazole?
The molecular weight of 4-Bromo-1-(2,5-difluorophenyl)sulfonylpyrazole is 321.92 g/mol.
Where can I buy 4-Bromo-1-(2,5-difluorophenyl)sulfonylpyrazole?
You can request a quote for 4-Bromo-1-(2,5-difluorophenyl)sulfonylpyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromo-1-(2,5-difluorophenyl)sulfonylpyrazole?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromo-1-(2,5-difluorophenyl)sulfonylpyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.