1-(4-Chloro-3-(trifluoromethyl)benzenesulfonyl)piperazine
TL;DR: 1-(4-Chloro-3-(trifluoromethyl)benzenesulfonyl)piperazine (CAS 97630-13-2) is a chemical compound with molecular formula C11H12ClF3N2O2S and molecular weight 328.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonylpiperazine
Also Known As: 1-[4-chloro-3-(trifluoromethyl)benzenesulfonyl]piperazine, 1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonylpiperazine, 1-{[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl}piperazine, 1-([4-chloro-3-(trifluoromethyl)phenyl]sulfonyl)piperazine, Piperazine, 1-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl]-
| Molecular Formula | C11H12ClF3N2O2S |
|---|---|
| Molecular Weight | 328.03 g/mol |
| LogP | 1.9527 |
| Topological Polar Surface Area | 49.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 328.026 |
| Heavy Atoms | 20 |
| Complexity | 598.1761 |
Chemical Identifiers
| CAS Number | 97630-13-2 |
|---|---|
| SMILES | C1CN(CCN1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(F)(F)F |
Product Overview
1-(4-Chloro-3-(trifluoromethyl)benzenesulfonyl)piperazine (CAS 97630-13-2), with molecular formula C11H12ClF3N2O2S and molecular weight 328.03 g/mol. IUPAC: 1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonylpiperazine.
Chemical Property Profile of 1-(4-Chloro-3-(trifluoromethyl)benzenesulfonyl)piperazine
Property Insights of 1-(4-Chloro-3-(trifluoromethyl)benzenesulfonyl)piperazine
The XLogP value of 1.9527 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Chloro-3-(trifluoromethyl)benzenesulfonyl)piperazine. With a topological polar surface area (TPSA) of 49.41 Ų, 1-(4-Chloro-3-(trifluoromethyl)benzenesulfonyl)piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Chloro-3-(trifluoromethyl)benzenesulfonyl)piperazine has 1 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-(4-Chloro-3-(trifluoromethyl)benzenesulfonyl)piperazine?
The CAS number of 1-(4-Chloro-3-(trifluoromethyl)benzenesulfonyl)piperazine is 97630-13-2.
What is the molecular formula of 1-(4-Chloro-3-(trifluoromethyl)benzenesulfonyl)piperazine?
The molecular formula of 1-(4-Chloro-3-(trifluoromethyl)benzenesulfonyl)piperazine is C11H12ClF3N2O2S.
What is the molecular weight of 1-(4-Chloro-3-(trifluoromethyl)benzenesulfonyl)piperazine?
The molecular weight of 1-(4-Chloro-3-(trifluoromethyl)benzenesulfonyl)piperazine is 328.03 g/mol.
Where can I buy 1-(4-Chloro-3-(trifluoromethyl)benzenesulfonyl)piperazine?
You can request a quote for 1-(4-Chloro-3-(trifluoromethyl)benzenesulfonyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Chloro-3-(trifluoromethyl)benzenesulfonyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Chloro-3-(trifluoromethyl)benzenesulfonyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.