![1-[3-(2,5-Dichlorophenyl)sulfanylpropyl]piperazine structure](/static/products/5422/5422-90-2.webp)
1-[3-(2,5-Dichlorophenyl)sulfanylpropyl]piperazine
TL;DR: 1-[3-(2,5-Dichlorophenyl)sulfanylpropyl]piperazine (CAS 5422-90-2) is a chemical compound with molecular formula C13H18Cl2N2S and molecular weight 304.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-(2,5-dichlorophenyl)sulfanylpropyl]piperazine
Also Known As: Cyclopentyl(phenyl)methanone, NCIStruc1_001134, NCIStruc2_000953, 1-[3-(2,5-dichlorophenyl)sulfanylpropyl]piperazine, NCI60_000187
| Molecular Formula | C13H18Cl2N2S |
|---|---|
| Molecular Weight | 304.06 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 40.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 304.05676 |
| Heavy Atoms | 18 |
| Complexity | 237.0 |
Chemical Identifiers
| CAS Number | 5422-90-2 |
|---|---|
| SMILES | C1CN(CCN1)CCCSC2=C(C=CC(=C2)Cl)Cl |
| InChIKey | YCJUISCEMNHDHX-UHFFFAOYSA-N |
Product Overview
1-[3-(2,5-Dichlorophenyl)sulfanylpropyl]piperazine (CAS 5422-90-2), with molecular formula C13H18Cl2N2S and molecular weight 304.06 g/mol. IUPAC: 1-[3-(2,5-dichlorophenyl)sulfanylpropyl]piperazine.
Chemical Property Profile of 1-[3-(2,5-Dichlorophenyl)sulfanylpropyl]piperazine
Property Insights of 1-[3-(2,5-Dichlorophenyl)sulfanylpropyl]piperazine
The XLogP value of 3.4 indicates that 1-[3-(2,5-Dichlorophenyl)sulfanylpropyl]piperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.6 Ų, 1-[3-(2,5-Dichlorophenyl)sulfanylpropyl]piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[3-(2,5-Dichlorophenyl)sulfanylpropyl]piperazine 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 1-[3-(2,5-Dichlorophenyl)sulfanylpropyl]piperazine?
The CAS number of 1-[3-(2,5-Dichlorophenyl)sulfanylpropyl]piperazine is 5422-90-2.
What is the molecular formula of 1-[3-(2,5-Dichlorophenyl)sulfanylpropyl]piperazine?
The molecular formula of 1-[3-(2,5-Dichlorophenyl)sulfanylpropyl]piperazine is C13H18Cl2N2S.
What is the molecular weight of 1-[3-(2,5-Dichlorophenyl)sulfanylpropyl]piperazine?
The molecular weight of 1-[3-(2,5-Dichlorophenyl)sulfanylpropyl]piperazine is 304.06 g/mol.
Where can I buy 1-[3-(2,5-Dichlorophenyl)sulfanylpropyl]piperazine?
You can request a quote for 1-[3-(2,5-Dichlorophenyl)sulfanylpropyl]piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[3-(2,5-Dichlorophenyl)sulfanylpropyl]piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-[3-(2,5-Dichlorophenyl)sulfanylpropyl]piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.