![4-[[3-(Trifluoromethyl)phenyl]sulfonyl]-1-piperazineethanol structure](/static/products/976/97630-02-9.png)
4-[[3-(Trifluoromethyl)phenyl]sulfonyl]-1-piperazineethanol
TL;DR: 4-[[3-(Trifluoromethyl)phenyl]sulfonyl]-1-piperazineethanol (CAS 97630-02-9) is a chemical compound with molecular formula C13H17F3N2O3S and molecular weight 338.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]ethanol
Also Known As: 4-[[3-(Trifluoromethyl)phenyl]sulfonyl]-1-piperazineethanol, 2-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]ethanol, 2-{4-[3-(Trifluoromethyl)benzene-1-sulfonyl]piperazin-1-yl}ethan-1-ol
| Molecular Formula | C13H17F3N2O3S |
|---|---|
| Molecular Weight | 338.09 g/mol |
| LogP | 1.004 |
| Topological Polar Surface Area | 60.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 338.0912 |
| Heavy Atoms | 22 |
| Complexity | 611.2015 |
Chemical Identifiers
| CAS Number | 97630-02-9 |
|---|---|
| SMILES | C1CN(CCN1CCO)S(=O)(=O)C2=CC=CC(=C2)C(F)(F)F |
Product Overview
4-[[3-(Trifluoromethyl)phenyl]sulfonyl]-1-piperazineethanol (CAS 97630-02-9), with molecular formula C13H17F3N2O3S and molecular weight 338.09 g/mol. IUPAC: 2-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]ethanol.
Chemical Property Profile of 4-[[3-(Trifluoromethyl)phenyl]sulfonyl]-1-piperazineethanol
Property Insights of 4-[[3-(Trifluoromethyl)phenyl]sulfonyl]-1-piperazineethanol
The XLogP value of 1.004 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[[3-(Trifluoromethyl)phenyl]sulfonyl]-1-piperazineethanol. The TPSA of 60.85 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[[3-(Trifluoromethyl)phenyl]sulfonyl]-1-piperazineethanol. Following Lipinski's Rule of Five, 4-[[3-(Trifluoromethyl)phenyl]sulfonyl]-1-piperazineethanol has 1 hydrogen bond donor(s) and 4 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-[[3-(Trifluoromethyl)phenyl]sulfonyl]-1-piperazineethanol?
The CAS number of 4-[[3-(Trifluoromethyl)phenyl]sulfonyl]-1-piperazineethanol is 97630-02-9.
What is the molecular formula of 4-[[3-(Trifluoromethyl)phenyl]sulfonyl]-1-piperazineethanol?
The molecular formula of 4-[[3-(Trifluoromethyl)phenyl]sulfonyl]-1-piperazineethanol is C13H17F3N2O3S.
What is the molecular weight of 4-[[3-(Trifluoromethyl)phenyl]sulfonyl]-1-piperazineethanol?
The molecular weight of 4-[[3-(Trifluoromethyl)phenyl]sulfonyl]-1-piperazineethanol is 338.09 g/mol.
Where can I buy 4-[[3-(Trifluoromethyl)phenyl]sulfonyl]-1-piperazineethanol?
You can request a quote for 4-[[3-(Trifluoromethyl)phenyl]sulfonyl]-1-piperazineethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[[3-(Trifluoromethyl)phenyl]sulfonyl]-1-piperazineethanol?
Yes, KEHONG BIO provides custom synthesis services for 4-[[3-(Trifluoromethyl)phenyl]sulfonyl]-1-piperazineethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.