RefChem:371853
TL;DR: RefChem:371853 (CAS 112446-59-0) is a chemical compound with molecular formula C24H25Cl5N2S and molecular weight 548.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[1-[5-chloro-2-(3,4-dichlorophenyl)sulfanylphenyl]ethyl]-4-phenylpiperazine;dihydrochloride
Also Known As: Piperazine, 1-(1-(5-chloro-2-((3,4-dichlorophenyl)thio)phenyl)ethyl)-4-phenyl-, dihydrochloride, 1-(1-{5-Chloro-2-[(3,4-dichlorophenyl)sulfanyl]phenyl}ethyl)-4-phenylpiperazine--hydrogen chloride (1/2), 1-[1-[5-chloro-2-(3,4-dichlorophenyl)sulfanylphenyl]ethyl]-4-phenylpiperazine dihydrochloride, RefChem:371853
| Molecular Formula | C24H25Cl5N2S |
|---|---|
| Molecular Weight | 548.02 g/mol |
| LogP | 8.5248 |
| Topological Polar Surface Area | 6.48 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 548.0181 |
| Heavy Atoms | 32 |
| Complexity | 1010.52637 |
Chemical Identifiers
| CAS Number | 112446-59-0 |
|---|---|
| SMILES | CC(C1=C(C=CC(=C1)Cl)SC2=CC(=C(C=C2)Cl)Cl)N3CCN(CC3)C4=CC=CC=C4.Cl.Cl |
Product Overview
RefChem:371853 (CAS 112446-59-0), with molecular formula C24H25Cl5N2S and molecular weight 548.02 g/mol. IUPAC: 1-[1-[5-chloro-2-(3,4-dichlorophenyl)sulfanylphenyl]ethyl]-4-phenylpiperazine;dihydrochloride.
Chemical Property Profile of RefChem:371853
Property Insights of RefChem:371853
The XLogP value of 8.5248 indicates that RefChem:371853 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 6.48 Ų, RefChem:371853 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:371853 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 RefChem:371853?
The CAS number of RefChem:371853 is 112446-59-0.
What is the molecular formula of RefChem:371853?
The molecular formula of RefChem:371853 is C24H25Cl5N2S.
What is the molecular weight of RefChem:371853?
The molecular weight of RefChem:371853 is 548.02 g/mol.
Where can I buy RefChem:371853?
You can request a quote for RefChem:371853 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:371853?
Yes, KEHONG BIO provides custom synthesis services for RefChem:371853 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.