RefChem:1095986
TL;DR: RefChem:1095986 (CAS 40028-25-9) is a chemical compound with molecular formula C26H32N2O6 and molecular weight 468.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-but-2-enedioic acid;1-[4-[1-(4-methoxyphenyl)-3-phenylpropyl]piperazin-1-yl]ethanone
Also Known As: 1-Acetyl-4-(1-(4-methoxyphenyl)-3-phenylpropyl)piperazine maleate, Piperazine, 1-acetyl-4-(1-(4-methoxyphenyl)-3-phenylpropyl)-, (Z)-2-butenedioate (1:1), 1-(1-(4-Methoxyphenyl)-3-phenylpropyl)-4-acetylpiperazine hydrogen maleate, (E)-but-2-enedioic acid; 1-[4-[1-(4-methoxyphenyl)-3-phenylpropyl]piperazin-1-yl]ethanone, RefChem:1095986
| Molecular Formula | C26H32N2O6 |
|---|---|
| Molecular Weight | 468.23 g/mol |
| LogP | 3.245 |
| Topological Polar Surface Area | 107.38 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 468.22604 |
| Heavy Atoms | 34 |
| Complexity | 935.0159 |
Chemical Identifiers
| CAS Number | 40028-25-9 |
|---|---|
| SMILES | CC(=O)N1CCN(CC1)C(CCC2=CC=CC=C2)C3=CC=C(C=C3)OC.C(=C/C(=O)O)\C(=O)O |
Product Overview
RefChem:1095986 (CAS 40028-25-9), with molecular formula C26H32N2O6 and molecular weight 468.23 g/mol. IUPAC: (E)-but-2-enedioic acid;1-[4-[1-(4-methoxyphenyl)-3-phenylpropyl]piperazin-1-yl]ethanone.
Chemical Property Profile of RefChem:1095986
Property Insights of RefChem:1095986
The XLogP value of 3.245 indicates that RefChem:1095986 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.38 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1095986. Following Lipinski's Rule of Five, RefChem:1095986 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 RefChem:1095986?
The CAS number of RefChem:1095986 is 40028-25-9.
What is the molecular formula of RefChem:1095986?
The molecular formula of RefChem:1095986 is C26H32N2O6.
What is the molecular weight of RefChem:1095986?
The molecular weight of RefChem:1095986 is 468.23 g/mol.
Where can I buy RefChem:1095986?
You can request a quote for RefChem:1095986 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1095986?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1095986 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.