1-(3-Chloro-4-fluorophenyl)sulfonyl-3,5-dimethylpiperidine
TL;DR: 1-(3-Chloro-4-fluorophenyl)sulfonyl-3,5-dimethylpiperidine (CAS 613657-50-4) is a chemical compound with molecular formula C13H17ClFNO2S and molecular weight 305.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-chloro-4-fluorophenyl)sulfonyl-3,5-dimethylpiperidine
Also Known As: F3394-0155, 1-(3-CHLORO-4-FLUOROBENZENESULFONYL)-3,5-DIMETHYLPIPERIDINE, 1-((3-chloro-4-fluorophenyl)sulfonyl)-3,5-dimethylpiperidine, 1-(3-chloro-4-fluorophenyl)sulfonyl-3,5-dimethylpiperidine, 1-(3-chloro-4-fluorophenylsulfonyl)-3,5-dimethylpiperidine
| Molecular Formula | C13H17ClFNO2S |
|---|---|
| Molecular Weight | 305.07 g/mol |
| LogP | 3.1457 |
| Topological Polar Surface Area | 37.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 305.06525 |
| Heavy Atoms | 19 |
| Complexity | 566.006 |
Chemical Identifiers
| CAS Number | 613657-50-4 |
|---|---|
| SMILES | CC1CC(CN(C1)S(=O)(=O)C2=CC(=C(C=C2)F)Cl)C |
Product Overview
1-(3-Chloro-4-fluorophenyl)sulfonyl-3,5-dimethylpiperidine (CAS 613657-50-4), with molecular formula C13H17ClFNO2S and molecular weight 305.07 g/mol. IUPAC: 1-(3-chloro-4-fluorophenyl)sulfonyl-3,5-dimethylpiperidine.
Chemical Property Profile of 1-(3-Chloro-4-fluorophenyl)sulfonyl-3,5-dimethylpiperidine
Property Insights of 1-(3-Chloro-4-fluorophenyl)sulfonyl-3,5-dimethylpiperidine
The XLogP value of 3.1457 indicates that 1-(3-Chloro-4-fluorophenyl)sulfonyl-3,5-dimethylpiperidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.38 Ų, 1-(3-Chloro-4-fluorophenyl)sulfonyl-3,5-dimethylpiperidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-Chloro-4-fluorophenyl)sulfonyl-3,5-dimethylpiperidine has 0 hydrogen bond donor(s) and 2 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-(3-Chloro-4-fluorophenyl)sulfonyl-3,5-dimethylpiperidine?
The CAS number of 1-(3-Chloro-4-fluorophenyl)sulfonyl-3,5-dimethylpiperidine is 613657-50-4.
What is the molecular formula of 1-(3-Chloro-4-fluorophenyl)sulfonyl-3,5-dimethylpiperidine?
The molecular formula of 1-(3-Chloro-4-fluorophenyl)sulfonyl-3,5-dimethylpiperidine is C13H17ClFNO2S.
What is the molecular weight of 1-(3-Chloro-4-fluorophenyl)sulfonyl-3,5-dimethylpiperidine?
The molecular weight of 1-(3-Chloro-4-fluorophenyl)sulfonyl-3,5-dimethylpiperidine is 305.07 g/mol.
Where can I buy 1-(3-Chloro-4-fluorophenyl)sulfonyl-3,5-dimethylpiperidine?
You can request a quote for 1-(3-Chloro-4-fluorophenyl)sulfonyl-3,5-dimethylpiperidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-Chloro-4-fluorophenyl)sulfonyl-3,5-dimethylpiperidine?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Chloro-4-fluorophenyl)sulfonyl-3,5-dimethylpiperidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.