RefChem:372002
TL;DR: RefChem:372002 (CAS 22663-53-2) is a chemical compound with molecular formula C25H27ClN4O5 and molecular weight 498.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[2-[(4-chlorophenyl)-phenylmethoxy]ethyl]piperazin-1-yl]pyrimidine;oxalic acid
Also Known As: 1-(2-(alpha-(p-Chlorophenyl)benzyloxy)ethyl)-4-(2-pyrimidyl)piperazine oxalate, Piperazine, 1-(2-(alpha-(p-chlorophenyl)benzyloxy)ethyl)-4-(2-pyrimidyl)-, oxalate, 2-(4-{2-[(4-chlorophenyl)(phenyl)methoxy]ethyl}piperazin-1-yl)pyrimidine ethanedioate(1:1), 2-[4-[2-[(4-Chlorophenyl)-phenylmethoxy]ethyl]piperazin-1-yl]pyrimidine;oxalic acid, 2-[4-[2-[(4-chlorophenyl)-phenylmethoxy]ethyl]piperazin-1-yl]pyrimidine; oxalic acid
| Molecular Formula | C25H27ClN4O5 |
|---|---|
| Molecular Weight | 498.17 g/mol |
| LogP | 3.21 |
| Topological Polar Surface Area | 116.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 498.167 |
| Heavy Atoms | 35 |
| Complexity | 525.0 |
Chemical Identifiers
| CAS Number | 22663-53-2 |
|---|---|
| SMILES | C1CN(CCN1CCOC(C2=CC=CC=C2)C3=CC=C(C=C3)Cl)C4=NC=CC=N4.C(=O)(C(=O)O)O |
| InChIKey | OELWISXAGSHZMH-UHFFFAOYSA-N |
Product Overview
RefChem:372002 (CAS 22663-53-2), with molecular formula C25H27ClN4O5 and molecular weight 498.17 g/mol. IUPAC: 2-[4-[2-[(4-chlorophenyl)-phenylmethoxy]ethyl]piperazin-1-yl]pyrimidine;oxalic acid.
Chemical Property Profile of RefChem:372002
Property Insights of RefChem:372002
The XLogP value of 3.21 indicates that RefChem:372002 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:372002. Following Lipinski's Rule of Five, RefChem:372002 has 2 hydrogen bond donor(s) and 9 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:372002?
The CAS number of RefChem:372002 is 22663-53-2.
What is the molecular formula of RefChem:372002?
The molecular formula of RefChem:372002 is C25H27ClN4O5.
What is the molecular weight of RefChem:372002?
The molecular weight of RefChem:372002 is 498.17 g/mol.
Where can I buy RefChem:372002?
You can request a quote for RefChem:372002 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:372002?
Yes, KEHONG BIO provides custom synthesis services for RefChem:372002 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.