1-Piperazinepropionic acid, 4-(2-((alpha-propylbenzyl)oxy)ethyl)-, maleate (1:2)
TL;DR: 1-Piperazinepropionic acid, 4-(2-((alpha-propylbenzyl)oxy)ethyl)-, maleate (1:2) (CAS 61897-45-8) is a chemical compound with molecular formula C27H38N2O11 and molecular weight 566.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis((E)-but-2-enedioic acid);3-[4-[2-(1-phenylbutoxy)ethyl]piperazin-1-yl]propanoic acid
Also Known As: 4-(2-((alpha-Propylbenzyl)oxy)ethyl)-1-piperazinepropionic acid maleate (1:2), 1-Piperazinepropionic acid, 4-(2-((alpha-propylbenzyl)oxy)ethyl)-, maleate (1:2), (E)-but-2-enedioic acid; 3-[4-[2-(1-phenylbutoxy)ethyl]piperazin-1-yl]propanoic acid, RefChem:1056690
| Molecular Formula | C27H38N2O11 |
|---|---|
| Molecular Weight | 566.25 g/mol |
| LogP | 2.0603 |
| Topological Polar Surface Area | 202.21 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 14 |
| Exact Mass | 566.24756 |
| Heavy Atoms | 40 |
| Complexity | 905.95166 |
Chemical Identifiers
| CAS Number | 61897-45-8 |
|---|---|
| SMILES | CCCC(OCCN1CCN(CC1)CCC(=O)O)C2=CC=CC=C2.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O |
Product Overview
1-Piperazinepropionic acid, 4-(2-((alpha-propylbenzyl)oxy)ethyl)-, maleate (1:2) (CAS 61897-45-8), with molecular formula C27H38N2O11 and molecular weight 566.25 g/mol. IUPAC: bis((E)-but-2-enedioic acid);3-[4-[2-(1-phenylbutoxy)ethyl]piperazin-1-yl]propanoic acid.
Chemical Property Profile of 1-Piperazinepropionic acid, 4-(2-((alpha-propylbenzyl)oxy)ethyl)-, maleate (1:2)
Property Insights of 1-Piperazinepropionic acid, 4-(2-((alpha-propylbenzyl)oxy)ethyl)-, maleate (1:2)
The XLogP value of 2.0603 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Piperazinepropionic acid, 4-(2-((alpha-propylbenzyl)oxy)ethyl)-, maleate (1:2). The TPSA of 202.21 Ų indicates high polarity, suggesting 1-Piperazinepropionic acid, 4-(2-((alpha-propylbenzyl)oxy)ethyl)-, maleate (1:2) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-Piperazinepropionic acid, 4-(2-((alpha-propylbenzyl)oxy)ethyl)-, maleate (1:2) has 5 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 1-Piperazinepropionic acid, 4-(2-((alpha-propylbenzyl)oxy)ethyl)-, maleate (1:2)?
The CAS number of 1-Piperazinepropionic acid, 4-(2-((alpha-propylbenzyl)oxy)ethyl)-, maleate (1:2) is 61897-45-8.
What is the molecular formula of 1-Piperazinepropionic acid, 4-(2-((alpha-propylbenzyl)oxy)ethyl)-, maleate (1:2)?
The molecular formula of 1-Piperazinepropionic acid, 4-(2-((alpha-propylbenzyl)oxy)ethyl)-, maleate (1:2) is C27H38N2O11.
What is the molecular weight of 1-Piperazinepropionic acid, 4-(2-((alpha-propylbenzyl)oxy)ethyl)-, maleate (1:2)?
The molecular weight of 1-Piperazinepropionic acid, 4-(2-((alpha-propylbenzyl)oxy)ethyl)-, maleate (1:2) is 566.25 g/mol.
Where can I buy 1-Piperazinepropionic acid, 4-(2-((alpha-propylbenzyl)oxy)ethyl)-, maleate (1:2)?
You can request a quote for 1-Piperazinepropionic acid, 4-(2-((alpha-propylbenzyl)oxy)ethyl)-, maleate (1:2) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Piperazinepropionic acid, 4-(2-((alpha-propylbenzyl)oxy)ethyl)-, maleate (1:2)?
Yes, KEHONG BIO provides custom synthesis services for 1-Piperazinepropionic acid, 4-(2-((alpha-propylbenzyl)oxy)ethyl)-, maleate (1:2) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.