Piperazine, 1-(1-naphthalenyl)-, (Z)-2-butenedioate (1:1)
TL;DR: Piperazine, 1-(1-naphthalenyl)-, (Z)-2-butenedioate (1:1) (CAS 57536-95-5) is a chemical compound with molecular formula C18H20N2O4 and molecular weight 328.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-but-2-enedioic acid;1-naphthalen-1-ylpiperazine
Also Known As: 1-(1-Naphthyl)piperazine maleate, Piperazine, 1-(1-naphthalenyl)-, (Z)-2-butenedioate (1:1), (E)-but-2-enedioic acid; 1-naphthalen-1-ylpiperazine, RefChem:1095700
| Molecular Formula | C18H20N2O4 |
|---|---|
| Molecular Weight | 328.14 g/mol |
| LogP | 1.9612 |
| Topological Polar Surface Area | 89.87 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 328.1423 |
| Heavy Atoms | 24 |
| Complexity | 715.3811 |
Chemical Identifiers
| CAS Number | 57536-95-5 |
|---|---|
| SMILES | C1CN(CCN1)C2=CC=CC3=CC=CC=C32.C(=C/C(=O)O)\C(=O)O |
Product Overview
Piperazine, 1-(1-naphthalenyl)-, (Z)-2-butenedioate (1:1) (CAS 57536-95-5), with molecular formula C18H20N2O4 and molecular weight 328.14 g/mol. IUPAC: (E)-but-2-enedioic acid;1-naphthalen-1-ylpiperazine.
Chemical Property Profile of Piperazine, 1-(1-naphthalenyl)-, (Z)-2-butenedioate (1:1)
Property Insights of Piperazine, 1-(1-naphthalenyl)-, (Z)-2-butenedioate (1:1)
The XLogP value of 1.9612 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Piperazine, 1-(1-naphthalenyl)-, (Z)-2-butenedioate (1:1). The TPSA of 89.87 Ų falls within the moderate polarity range, balancing permeability and solubility for Piperazine, 1-(1-naphthalenyl)-, (Z)-2-butenedioate (1:1). Following Lipinski's Rule of Five, Piperazine, 1-(1-naphthalenyl)-, (Z)-2-butenedioate (1:1) has 3 hydrogen bond donor(s) and 4 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 Piperazine, 1-(1-naphthalenyl)-, (Z)-2-butenedioate (1:1)?
The CAS number of Piperazine, 1-(1-naphthalenyl)-, (Z)-2-butenedioate (1:1) is 57536-95-5.
What is the molecular formula of Piperazine, 1-(1-naphthalenyl)-, (Z)-2-butenedioate (1:1)?
The molecular formula of Piperazine, 1-(1-naphthalenyl)-, (Z)-2-butenedioate (1:1) is C18H20N2O4.
What is the molecular weight of Piperazine, 1-(1-naphthalenyl)-, (Z)-2-butenedioate (1:1)?
The molecular weight of Piperazine, 1-(1-naphthalenyl)-, (Z)-2-butenedioate (1:1) is 328.14 g/mol.
Where can I buy Piperazine, 1-(1-naphthalenyl)-, (Z)-2-butenedioate (1:1)?
You can request a quote for Piperazine, 1-(1-naphthalenyl)-, (Z)-2-butenedioate (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Piperazine, 1-(1-naphthalenyl)-, (Z)-2-butenedioate (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Piperazine, 1-(1-naphthalenyl)-, (Z)-2-butenedioate (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.