RefChem:1095693
TL;DR: RefChem:1095693 (CAS 40028-11-3) is a chemical compound with molecular formula C29H36N2O9 and molecular weight 556.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis((E)-but-2-enedioic acid);1-[1-(4-methoxyphenyl)-3-phenylpropyl]-4-methylpiperazine
Also Known As: 1-(1-(4-Methoxyphenyl)-3-phenylpropyl)-4-methylpiperazine dimaleate, Piperazine, 1-(1-(4-methoxyphenyl)-3-phenylpropyl)-4-methyl-, (Z)-2-butenedioate (1:2), (E)-but-2-enedioic acid; 1-[1-(4-methoxyphenyl)-3-phenylpropyl]-4-methylpiperazine, RefChem:1095693
| Molecular Formula | C29H36N2O9 |
|---|---|
| Molecular Weight | 556.24 g/mol |
| LogP | 3.0401 |
| Topological Polar Surface Area | 164.91 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 556.24207 |
| Heavy Atoms | 40 |
| Complexity | 1057.9535 |
Chemical Identifiers
| CAS Number | 40028-11-3 |
|---|---|
| SMILES | CN1CCN(CC1)C(C2=CC=C(C=C2)OC)CCC3=CC=CC=C3.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O |
Product Overview
RefChem:1095693 (CAS 40028-11-3), with molecular formula C29H36N2O9 and molecular weight 556.24 g/mol. IUPAC: bis((E)-but-2-enedioic acid);1-[1-(4-methoxyphenyl)-3-phenylpropyl]-4-methylpiperazine.
Chemical Property Profile of RefChem:1095693
Property Insights of RefChem:1095693
The XLogP value of 3.0401 indicates that RefChem:1095693 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 164.91 Ų indicates high polarity, suggesting RefChem:1095693 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:1095693 has 4 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:1095693?
The CAS number of RefChem:1095693 is 40028-11-3.
What is the molecular formula of RefChem:1095693?
The molecular formula of RefChem:1095693 is C29H36N2O9.
What is the molecular weight of RefChem:1095693?
The molecular weight of RefChem:1095693 is 556.24 g/mol.
Where can I buy RefChem:1095693?
You can request a quote for RefChem:1095693 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1095693?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1095693 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.