![1-(4-Benzylpiperidin-1-yl)-2-[(4-chlorophenyl)methylsulfanyl]ethanone structure](/static/products/4284/428487-31-4.webp)
1-(4-Benzylpiperidin-1-yl)-2-[(4-chlorophenyl)methylsulfanyl]ethanone
TL;DR: 1-(4-Benzylpiperidin-1-yl)-2-[(4-chlorophenyl)methylsulfanyl]ethanone (CAS 428487-31-4) is a chemical compound with molecular formula C21H24ClNOS and molecular weight 373.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-benzylpiperidin-1-yl)-2-[(4-chlorophenyl)methylsulfanyl]ethanone
Also Known As: 4-benzyl-1-{[(4-chlorobenzyl)thio]acetyl}piperidine, 1-(4-benzylpiperidin-1-yl)-2-[(4-chlorophenyl)methylsulfanyl]ethanone, 2-[[(4-Chlorophenyl)methyl]thio]-1-[4-(phenylmethyl)-1-piperidinyl]ethanone, 1-(4-Benzylpiperidin-1-yl)-2-{[(4-chlorophenyl)methyl]sulfanyl}ethan-1-one
| Molecular Formula | C21H24ClNOS |
|---|---|
| Molecular Weight | 373.13 g/mol |
| LogP | 5.0545 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 373.1267 |
| Heavy Atoms | 25 |
| Complexity | 666.05524 |
Chemical Identifiers
| CAS Number | 428487-31-4 |
|---|---|
| SMILES | C1CN(CCC1CC2=CC=CC=C2)C(=O)CSCC3=CC=C(C=C3)Cl |
Product Overview
1-(4-Benzylpiperidin-1-yl)-2-[(4-chlorophenyl)methylsulfanyl]ethanone (CAS 428487-31-4), with molecular formula C21H24ClNOS and molecular weight 373.13 g/mol. IUPAC: 1-(4-benzylpiperidin-1-yl)-2-[(4-chlorophenyl)methylsulfanyl]ethanone.
Chemical Property Profile of 1-(4-Benzylpiperidin-1-yl)-2-[(4-chlorophenyl)methylsulfanyl]ethanone
Property Insights of 1-(4-Benzylpiperidin-1-yl)-2-[(4-chlorophenyl)methylsulfanyl]ethanone
The XLogP value of 5.0545 indicates that 1-(4-Benzylpiperidin-1-yl)-2-[(4-chlorophenyl)methylsulfanyl]ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.31 Ų, 1-(4-Benzylpiperidin-1-yl)-2-[(4-chlorophenyl)methylsulfanyl]ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Benzylpiperidin-1-yl)-2-[(4-chlorophenyl)methylsulfanyl]ethanone has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(4-Benzylpiperidin-1-yl)-2-[(4-chlorophenyl)methylsulfanyl]ethanone?
The CAS number of 1-(4-Benzylpiperidin-1-yl)-2-[(4-chlorophenyl)methylsulfanyl]ethanone is 428487-31-4.
What is the molecular formula of 1-(4-Benzylpiperidin-1-yl)-2-[(4-chlorophenyl)methylsulfanyl]ethanone?
The molecular formula of 1-(4-Benzylpiperidin-1-yl)-2-[(4-chlorophenyl)methylsulfanyl]ethanone is C21H24ClNOS.
What is the molecular weight of 1-(4-Benzylpiperidin-1-yl)-2-[(4-chlorophenyl)methylsulfanyl]ethanone?
The molecular weight of 1-(4-Benzylpiperidin-1-yl)-2-[(4-chlorophenyl)methylsulfanyl]ethanone is 373.13 g/mol.
Where can I buy 1-(4-Benzylpiperidin-1-yl)-2-[(4-chlorophenyl)methylsulfanyl]ethanone?
You can request a quote for 1-(4-Benzylpiperidin-1-yl)-2-[(4-chlorophenyl)methylsulfanyl]ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Benzylpiperidin-1-yl)-2-[(4-chlorophenyl)methylsulfanyl]ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Benzylpiperidin-1-yl)-2-[(4-chlorophenyl)methylsulfanyl]ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.