1-(2-Chlorophenyl)-4-[(4-methylphenyl)sulfanylmethyl]piperazine
TL;DR: 1-(2-Chlorophenyl)-4-[(4-methylphenyl)sulfanylmethyl]piperazine (CAS 6332-72-5) is a chemical compound with molecular formula C18H21ClN2S and molecular weight 332.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-chlorophenyl)-4-[(4-methylphenyl)sulfanylmethyl]piperazine
Also Known As: KST-1B6677, 1-(2-chlorophenyl)-4-[(4-methylphenyl)sulfanylmethyl]piperazine, 1-ethylsulfanylmethyl-4-p-tolyl-piperazine, 1-(2-chlorophenyl)-4-{[(4-methylphenyl)sulfanyl]methyl}piperazine, Piperazine,1-(2-chlorophenyl)-4-[[(4-methylphenyl)thio]methyl]-
| Molecular Formula | C18H21ClN2S |
|---|---|
| Molecular Weight | 332.11 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 31.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 332.1114 |
| Heavy Atoms | 22 |
| Complexity | 325.0 |
Chemical Identifiers
| CAS Number | 6332-72-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)SCN2CCN(CC2)C3=CC=CC=C3Cl |
| InChIKey | PXGWQZTVQBIJRH-UHFFFAOYSA-N |
Product Overview
1-(2-Chlorophenyl)-4-[(4-methylphenyl)sulfanylmethyl]piperazine (CAS 6332-72-5), with molecular formula C18H21ClN2S and molecular weight 332.11 g/mol. IUPAC: 1-(2-chlorophenyl)-4-[(4-methylphenyl)sulfanylmethyl]piperazine.
Chemical Property Profile of 1-(2-Chlorophenyl)-4-[(4-methylphenyl)sulfanylmethyl]piperazine
Property Insights of 1-(2-Chlorophenyl)-4-[(4-methylphenyl)sulfanylmethyl]piperazine
The XLogP value of 5.2 indicates that 1-(2-Chlorophenyl)-4-[(4-methylphenyl)sulfanylmethyl]piperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 31.8 Ų, 1-(2-Chlorophenyl)-4-[(4-methylphenyl)sulfanylmethyl]piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Chlorophenyl)-4-[(4-methylphenyl)sulfanylmethyl]piperazine has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(2-Chlorophenyl)-4-[(4-methylphenyl)sulfanylmethyl]piperazine?
The CAS number of 1-(2-Chlorophenyl)-4-[(4-methylphenyl)sulfanylmethyl]piperazine is 6332-72-5.
What is the molecular formula of 1-(2-Chlorophenyl)-4-[(4-methylphenyl)sulfanylmethyl]piperazine?
The molecular formula of 1-(2-Chlorophenyl)-4-[(4-methylphenyl)sulfanylmethyl]piperazine is C18H21ClN2S.
What is the molecular weight of 1-(2-Chlorophenyl)-4-[(4-methylphenyl)sulfanylmethyl]piperazine?
The molecular weight of 1-(2-Chlorophenyl)-4-[(4-methylphenyl)sulfanylmethyl]piperazine is 332.11 g/mol.
Where can I buy 1-(2-Chlorophenyl)-4-[(4-methylphenyl)sulfanylmethyl]piperazine?
You can request a quote for 1-(2-Chlorophenyl)-4-[(4-methylphenyl)sulfanylmethyl]piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Chlorophenyl)-4-[(4-methylphenyl)sulfanylmethyl]piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Chlorophenyl)-4-[(4-methylphenyl)sulfanylmethyl]piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.