RefChem:223063
TL;DR: RefChem:223063 (CAS 22663-52-1) is a chemical compound with molecular formula C28H31ClN2O6 and molecular weight 526.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-[(4-chlorophenyl)-phenylmethoxy]ethyl]-4-(4-methoxyphenyl)piperazine;oxalic acid
Also Known As: 1-(2-(alpha-(p-Chlorophenyl)benzyloxy)ethyl)-4-(p-methoxyphenyl)piperazine oxalate, 1,3-Propanediol,2-butyl-2-methyl-,allylcarbamate,carbamate, 1-[2-[(4-chlorophenyl)-phenylmethoxy]ethyl]-4-(4-methoxyphenyl)piperazine; oxalic acid, 1-{2-[(4-chlorophenyl)(phenyl)methoxy]ethyl}-4-(4-methoxyphenyl)piperazine ethanedioate(1:1), Piperazine, 1-(2-(alpha-(p-chlorophenyl)benzyloxy)ethyl)-4-(p-methoxyphenyl)-, oxalate
| Molecular Formula | C28H31ClN2O6 |
|---|---|
| Molecular Weight | 526.19 g/mol |
| LogP | 4.43 |
| Topological Polar Surface Area | 99.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 526.1871 |
| Heavy Atoms | 37 |
| Complexity | 563.0 |
Chemical Identifiers
| CAS Number | 22663-52-1 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2CCN(CC2)CCOC(C3=CC=CC=C3)C4=CC=C(C=C4)Cl.C(=O)(C(=O)O)O |
| InChIKey | XGENWMRCNATGIW-UHFFFAOYSA-N |
Product Overview
RefChem:223063 (CAS 22663-52-1), with molecular formula C28H31ClN2O6 and molecular weight 526.19 g/mol. IUPAC: 1-[2-[(4-chlorophenyl)-phenylmethoxy]ethyl]-4-(4-methoxyphenyl)piperazine;oxalic acid.
Chemical Property Profile of RefChem:223063
Property Insights of RefChem:223063
The XLogP value of 4.43 indicates that RefChem:223063 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.5 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:223063. Following Lipinski's Rule of Five, RefChem:223063 has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:223063?
The CAS number of RefChem:223063 is 22663-52-1.
What is the molecular formula of RefChem:223063?
The molecular formula of RefChem:223063 is C28H31ClN2O6.
What is the molecular weight of RefChem:223063?
The molecular weight of RefChem:223063 is 526.19 g/mol.
Where can I buy RefChem:223063?
You can request a quote for RefChem:223063 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:223063?
Yes, KEHONG BIO provides custom synthesis services for RefChem:223063 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.