4-(4-Methylbenzenesulfonyl)piperidine hydrochloride
TL;DR: 4-(4-Methylbenzenesulfonyl)piperidine hydrochloride (CAS 3470-46-0) is a chemical compound with molecular formula C12H18ClNO2S and molecular weight 275.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-methylphenyl)sulfonylpiperidine;hydrochloride
Also Known As: 4-tosylpiperidine hydrochloride, 4-[(4-Methylphenyl)Sulfonyl]Piperidine Hydrochloride, 3,4-Difluorophenylboronic acid, 4-[(4-methylphenyl)sulfonyl]piperidinehydrochloride, 4-(4-methylbenzenesulfonyl)piperidine hydrochloride
| Molecular Formula | C12H18ClNO2S |
|---|---|
| Molecular Weight | 275.07 g/mol |
| LogP | 1.94252 |
| Topological Polar Surface Area | 46.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 275.07468 |
| Heavy Atoms | 17 |
| Complexity | 449.8989 |
Chemical Identifiers
| CAS Number | 3470-46-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)C2CCNCC2.Cl |
Product Overview
4-(4-Methylbenzenesulfonyl)piperidine hydrochloride (CAS 3470-46-0), with molecular formula C12H18ClNO2S and molecular weight 275.07 g/mol. IUPAC: 4-(4-methylphenyl)sulfonylpiperidine;hydrochloride.
Chemical Property Profile of 4-(4-Methylbenzenesulfonyl)piperidine hydrochloride
Property Insights of 4-(4-Methylbenzenesulfonyl)piperidine hydrochloride
The XLogP value of 1.94252 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-Methylbenzenesulfonyl)piperidine hydrochloride. With a topological polar surface area (TPSA) of 46.17 Ų, 4-(4-Methylbenzenesulfonyl)piperidine hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-Methylbenzenesulfonyl)piperidine hydrochloride 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 4-(4-Methylbenzenesulfonyl)piperidine hydrochloride?
The CAS number of 4-(4-Methylbenzenesulfonyl)piperidine hydrochloride is 3470-46-0.
What is the molecular formula of 4-(4-Methylbenzenesulfonyl)piperidine hydrochloride?
The molecular formula of 4-(4-Methylbenzenesulfonyl)piperidine hydrochloride is C12H18ClNO2S.
What is the molecular weight of 4-(4-Methylbenzenesulfonyl)piperidine hydrochloride?
The molecular weight of 4-(4-Methylbenzenesulfonyl)piperidine hydrochloride is 275.07 g/mol.
Where can I buy 4-(4-Methylbenzenesulfonyl)piperidine hydrochloride?
You can request a quote for 4-(4-Methylbenzenesulfonyl)piperidine hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-Methylbenzenesulfonyl)piperidine hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Methylbenzenesulfonyl)piperidine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.