1-(2-Chlorobenzothioyl)piperidine
TL;DR: 1-(2-Chlorobenzothioyl)piperidine (CAS 95415-56-8) is a chemical compound with molecular formula C12H14ClNS and molecular weight 239.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-chlorophenyl)-piperidin-1-ylmethanethione
Also Known As: 1-(2-chlorobenzothioyl)piperidine, (2-chlorophenyl)-(1-piperidyl)methanethione, (2-chlorophenyl)-piperidin-1-ylmethanethione, Methanethione, (2-chlorophenyl)-1-piperidinyl
| Molecular Formula | C12H14ClNS |
|---|---|
| Molecular Weight | 239.05 g/mol |
| LogP | 3.5014 |
| Topological Polar Surface Area | 3.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 239.05354 |
| Heavy Atoms | 15 |
| Complexity | 358.39468 |
Chemical Identifiers
| CAS Number | 95415-56-8 |
|---|---|
| SMILES | C1CCN(CC1)C(=S)C2=CC=CC=C2Cl |
Product Overview
1-(2-Chlorobenzothioyl)piperidine (CAS 95415-56-8), with molecular formula C12H14ClNS and molecular weight 239.05 g/mol. IUPAC: (2-chlorophenyl)-piperidin-1-ylmethanethione.
Chemical Property Profile of 1-(2-Chlorobenzothioyl)piperidine
Property Insights of 1-(2-Chlorobenzothioyl)piperidine
The XLogP value of 3.5014 indicates that 1-(2-Chlorobenzothioyl)piperidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.24 Ų, 1-(2-Chlorobenzothioyl)piperidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Chlorobenzothioyl)piperidine has 0 hydrogen bond donor(s) and 1 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-(2-Chlorobenzothioyl)piperidine?
The CAS number of 1-(2-Chlorobenzothioyl)piperidine is 95415-56-8.
What is the molecular formula of 1-(2-Chlorobenzothioyl)piperidine?
The molecular formula of 1-(2-Chlorobenzothioyl)piperidine is C12H14ClNS.
What is the molecular weight of 1-(2-Chlorobenzothioyl)piperidine?
The molecular weight of 1-(2-Chlorobenzothioyl)piperidine is 239.05 g/mol.
Where can I buy 1-(2-Chlorobenzothioyl)piperidine?
You can request a quote for 1-(2-Chlorobenzothioyl)piperidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Chlorobenzothioyl)piperidine?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Chlorobenzothioyl)piperidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.