RefChem:218882
TL;DR: RefChem:218882 (CAS 71923-01-8) is a chemical compound with molecular formula C21H23Cl3N2O3 and molecular weight 456.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-chlorophenyl)-5-[2-(4-phenylpiperazin-1-yl)ethyl]-1,3-dioxol-2-one;dihydrochloride
Also Known As: 4-(4-chlorophenyl)-5-[2-(4-phenyl-1-piperazinyl)ethyl]-1,3-dioxol-2-one dihydrochloride, 1,3-Dioxol-2-one, 4-(4-chlorophenyl)-5-(2-(4-phenyl-1-piperazinyl)ethyl)-, dihydrochloride, 4-(4-Chlorophenyl)-5-(2-(4-phenyl-1-piperazinyl)ethyl)-1,3-dioxol-2-one dihydrochloride, 4-(4-chlorophenyl)-5-[2-(4-phenylpiperazin-1-yl)ethyl]-1,3-dioxol-2-one dihydrochloride, 4-(4-chlorophenyl)-5-[2-(4-phenylpiperazin-1-yl)ethyl]-1,3-dioxol-2-one,dihydrochloride
| Molecular Formula | C21H23Cl3N2O3 |
|---|---|
| Molecular Weight | 456.08 g/mol |
| LogP | 4.76 |
| Topological Polar Surface Area | 42.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 456.07742 |
| Heavy Atoms | 29 |
| Complexity | 546.0 |
Chemical Identifiers
| CAS Number | 71923-01-8 |
|---|---|
| SMILES | C1CN(CCN1CCC2=C(OC(=O)O2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4.Cl.Cl |
| InChIKey | ZUCYXPFLHXXOFU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
RefChem:218882 (CAS 71923-01-8), with molecular formula C21H23Cl3N2O3 and molecular weight 456.08 g/mol. IUPAC: 4-(4-chlorophenyl)-5-[2-(4-phenylpiperazin-1-yl)ethyl]-1,3-dioxol-2-one;dihydrochloride.
Chemical Property Profile of RefChem:218882
Property Insights of RefChem:218882
The XLogP value of 4.76 indicates that RefChem:218882 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.0 Ų, RefChem:218882 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:218882 has 2 hydrogen bond donor(s) and 5 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 RefChem:218882?
The CAS number of RefChem:218882 is 71923-01-8.
What is the molecular formula of RefChem:218882?
The molecular formula of RefChem:218882 is C21H23Cl3N2O3.
What is the molecular weight of RefChem:218882?
The molecular weight of RefChem:218882 is 456.08 g/mol.
Where can I buy RefChem:218882?
You can request a quote for RefChem:218882 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:218882?
Yes, KEHONG BIO provides custom synthesis services for RefChem:218882 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.