![1-[4-Chloro-3-(trifluoromethyl)phenyl]sulfonylpyrrolidine structure](/static/products/6120/612043-65-9.webp)
1-[4-Chloro-3-(trifluoromethyl)phenyl]sulfonylpyrrolidine
TL;DR: 1-[4-Chloro-3-(trifluoromethyl)phenyl]sulfonylpyrrolidine (CAS 612043-65-9) is a chemical compound with molecular formula C11H11ClF3NO2S and molecular weight 313.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonylpyrrolidine
Also Known As: 1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonylpyrrolidine, 1-((4-chloro-3-(trifluoromethyl)phenyl)sulfonyl)pyrrolidine, F1360-0697, AF-399/41610702, 1-[4-CHLORO-3-(TRIFLUOROMETHYL)BENZENESULFONYL]PYRROLIDINE
| Molecular Formula | C11H11ClF3NO2S |
|---|---|
| Molecular Weight | 313.02 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 313.0151 |
| Heavy Atoms | 19 |
| Complexity | 415.0 |
Chemical Identifiers
| CAS Number | 612043-65-9 |
|---|---|
| SMILES | C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(F)(F)F |
| InChIKey | JVGSEVZDIMISRV-UHFFFAOYSA-N |
Product Overview
1-[4-Chloro-3-(trifluoromethyl)phenyl]sulfonylpyrrolidine (CAS 612043-65-9), with molecular formula C11H11ClF3NO2S and molecular weight 313.02 g/mol. IUPAC: 1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonylpyrrolidine.
Chemical Property Profile of 1-[4-Chloro-3-(trifluoromethyl)phenyl]sulfonylpyrrolidine
Property Insights of 1-[4-Chloro-3-(trifluoromethyl)phenyl]sulfonylpyrrolidine
The XLogP value of 3.1 indicates that 1-[4-Chloro-3-(trifluoromethyl)phenyl]sulfonylpyrrolidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.8 Ų, 1-[4-Chloro-3-(trifluoromethyl)phenyl]sulfonylpyrrolidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[4-Chloro-3-(trifluoromethyl)phenyl]sulfonylpyrrolidine has 0 hydrogen bond donor(s) and 6 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)phenyl]sulfonylpyrrolidine?
The CAS number of 1-[4-Chloro-3-(trifluoromethyl)phenyl]sulfonylpyrrolidine is 612043-65-9.
What is the molecular formula of 1-[4-Chloro-3-(trifluoromethyl)phenyl]sulfonylpyrrolidine?
The molecular formula of 1-[4-Chloro-3-(trifluoromethyl)phenyl]sulfonylpyrrolidine is C11H11ClF3NO2S.
What is the molecular weight of 1-[4-Chloro-3-(trifluoromethyl)phenyl]sulfonylpyrrolidine?
The molecular weight of 1-[4-Chloro-3-(trifluoromethyl)phenyl]sulfonylpyrrolidine is 313.02 g/mol.
Where can I buy 1-[4-Chloro-3-(trifluoromethyl)phenyl]sulfonylpyrrolidine?
You can request a quote for 1-[4-Chloro-3-(trifluoromethyl)phenyl]sulfonylpyrrolidine 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)phenyl]sulfonylpyrrolidine?
Yes, KEHONG BIO provides custom synthesis services for 1-[4-Chloro-3-(trifluoromethyl)phenyl]sulfonylpyrrolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.