1-Piperazineethanol, 4-(4-cyclopentylphenyl)-alpha-ethyl-, (Z)-2-butenedioate
TL;DR: 1-Piperazineethanol, 4-(4-cyclopentylphenyl)-alpha-ethyl-, (Z)-2-butenedioate (CAS 113682-08-9) is a chemical compound with molecular formula C23H34N2O5 and molecular weight 418.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-but-2-enedioic acid;1-(2-cyclopentylphenyl)-4-(2-ethoxyethyl)piperazine
Also Known As: 1-(4-Cyclopentylphenyl)-4-(2-hydroxybutyl)piperazine maleate, 4-(4-Cyclopentylphenyl)-alpha-ethyl-1-piperazineethanol maleate, 1-Piperazineethanol, 4-(4-cyclopentylphenyl)-alpha-ethyl-, (Z)-2-butenedioate, (E)-but-2-enedioic acid; 1-(2-cyclopentylphenyl)-4-(2-ethoxyethyl)piperazine, RefChem:1056580
| Molecular Formula | C23H34N2O5 |
|---|---|
| Molecular Weight | 418.25 g/mol |
| LogP | 3.2145 |
| Topological Polar Surface Area | 90.31 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 418.24677 |
| Heavy Atoms | 30 |
| Complexity | 676.5888 |
Chemical Identifiers
| CAS Number | 113682-08-9 |
|---|---|
| SMILES | CCOCCN1CCN(CC1)C2=CC=CC=C2C3CCCC3.C(=C/C(=O)O)\C(=O)O |
Product Overview
1-Piperazineethanol, 4-(4-cyclopentylphenyl)-alpha-ethyl-, (Z)-2-butenedioate (CAS 113682-08-9), with molecular formula C23H34N2O5 and molecular weight 418.25 g/mol. IUPAC: (E)-but-2-enedioic acid;1-(2-cyclopentylphenyl)-4-(2-ethoxyethyl)piperazine.
Chemical Property Profile of 1-Piperazineethanol, 4-(4-cyclopentylphenyl)-alpha-ethyl-, (Z)-2-butenedioate
Property Insights of 1-Piperazineethanol, 4-(4-cyclopentylphenyl)-alpha-ethyl-, (Z)-2-butenedioate
The XLogP value of 3.2145 indicates that 1-Piperazineethanol, 4-(4-cyclopentylphenyl)-alpha-ethyl-, (Z)-2-butenedioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.31 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Piperazineethanol, 4-(4-cyclopentylphenyl)-alpha-ethyl-, (Z)-2-butenedioate. Following Lipinski's Rule of Five, 1-Piperazineethanol, 4-(4-cyclopentylphenyl)-alpha-ethyl-, (Z)-2-butenedioate 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 1-Piperazineethanol, 4-(4-cyclopentylphenyl)-alpha-ethyl-, (Z)-2-butenedioate?
The CAS number of 1-Piperazineethanol, 4-(4-cyclopentylphenyl)-alpha-ethyl-, (Z)-2-butenedioate is 113682-08-9.
What is the molecular formula of 1-Piperazineethanol, 4-(4-cyclopentylphenyl)-alpha-ethyl-, (Z)-2-butenedioate?
The molecular formula of 1-Piperazineethanol, 4-(4-cyclopentylphenyl)-alpha-ethyl-, (Z)-2-butenedioate is C23H34N2O5.
What is the molecular weight of 1-Piperazineethanol, 4-(4-cyclopentylphenyl)-alpha-ethyl-, (Z)-2-butenedioate?
The molecular weight of 1-Piperazineethanol, 4-(4-cyclopentylphenyl)-alpha-ethyl-, (Z)-2-butenedioate is 418.25 g/mol.
Where can I buy 1-Piperazineethanol, 4-(4-cyclopentylphenyl)-alpha-ethyl-, (Z)-2-butenedioate?
You can request a quote for 1-Piperazineethanol, 4-(4-cyclopentylphenyl)-alpha-ethyl-, (Z)-2-butenedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Piperazineethanol, 4-(4-cyclopentylphenyl)-alpha-ethyl-, (Z)-2-butenedioate?
Yes, KEHONG BIO provides custom synthesis services for 1-Piperazineethanol, 4-(4-cyclopentylphenyl)-alpha-ethyl-, (Z)-2-butenedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.