Sulfoxide, 2-piperidinoethyl p-tolyl, hydrochloride
TL;DR: Sulfoxide, 2-piperidinoethyl p-tolyl, hydrochloride (CAS 33580-96-0) is a chemical compound with molecular formula C14H22ClNOS and molecular weight 287.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(4-methylphenyl)sulfinylethyl]piperidine;hydrochloride
Also Known As: 2-Piperidinoethyl p-tolyl sulfoxide hydrochloride, Sulfoxide, 2-piperidinoethyl p-tolyl, hydrochloride, 1-[2-(4-methylphenyl)sulfinylethyl]piperidine hydrochloride, 1-{2-[(4-methylphenyl)sulfinyl]ethyl}piperidine hydrochloride(1:1), Piperidine, 1-[2-(p-tolylsulfinyl)ethyl]-, hydrochloride
| Molecular Formula | C14H22ClNOS |
|---|---|
| Molecular Weight | 287.11 g/mol |
| LogP | 3.01032 |
| Topological Polar Surface Area | 39.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 287.11105 |
| Heavy Atoms | 18 |
| Complexity | 243.0 |
Chemical Identifiers
| CAS Number | 33580-96-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)CCN2CCCCC2.Cl |
| InChIKey | XKSBYDYETRIQTH-UHFFFAOYSA-N |
Product Overview
Sulfoxide, 2-piperidinoethyl p-tolyl, hydrochloride (CAS 33580-96-0), with molecular formula C14H22ClNOS and molecular weight 287.11 g/mol. IUPAC: 1-[2-(4-methylphenyl)sulfinylethyl]piperidine;hydrochloride.
Chemical Property Profile of Sulfoxide, 2-piperidinoethyl p-tolyl, hydrochloride
Property Insights of Sulfoxide, 2-piperidinoethyl p-tolyl, hydrochloride
The XLogP value of 3.01032 indicates that Sulfoxide, 2-piperidinoethyl p-tolyl, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.5 Ų, Sulfoxide, 2-piperidinoethyl p-tolyl, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Sulfoxide, 2-piperidinoethyl p-tolyl, 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 Sulfoxide, 2-piperidinoethyl p-tolyl, hydrochloride?
The CAS number of Sulfoxide, 2-piperidinoethyl p-tolyl, hydrochloride is 33580-96-0.
What is the molecular formula of Sulfoxide, 2-piperidinoethyl p-tolyl, hydrochloride?
The molecular formula of Sulfoxide, 2-piperidinoethyl p-tolyl, hydrochloride is C14H22ClNOS.
What is the molecular weight of Sulfoxide, 2-piperidinoethyl p-tolyl, hydrochloride?
The molecular weight of Sulfoxide, 2-piperidinoethyl p-tolyl, hydrochloride is 287.11 g/mol.
Where can I buy Sulfoxide, 2-piperidinoethyl p-tolyl, hydrochloride?
You can request a quote for Sulfoxide, 2-piperidinoethyl p-tolyl, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sulfoxide, 2-piperidinoethyl p-tolyl, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Sulfoxide, 2-piperidinoethyl p-tolyl, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.