RefChem:1056633
TL;DR: RefChem:1056633 (CAS 40028-29-3) is a chemical compound with molecular formula C35H45N3O13 and molecular weight 715.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tris((E)-but-2-enedioic acid);3-[4-[1-(4-methoxyphenyl)-3-phenylpropyl]piperazin-1-yl]propan-1-amine
Also Known As: 4-(1-(4-Methoxyphenyl)-3-phenylpropyl)-1-piperazinepropanamine trimaleate, 1-Piperazinepropanamine, 4-(1-(4-methoxyphenyl)-3-phenylpropyl)-, (Z)-2-butenedioate (1:3), 1-(1-(4-Methoxyphenyl)-3-phenylpropyl)-4-(3-aminopropyl)piperazine tri(hydrogen maleate), (E)-but-2-enedioic acid; 3-[4-[1-(4-methoxyphenyl)-3-phenylpropyl]piperazin-1-yl]propan-1-amine, RefChem:1056633
| Molecular Formula | C35H45N3O13 |
|---|---|
| Molecular Weight | 715.30 g/mol |
| LogP | 2.4709 |
| Topological Polar Surface Area | 265.53 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 15 |
| Exact Mass | 715.2952 |
| Heavy Atoms | 51 |
| Complexity | 1322.2166 |
Chemical Identifiers
| CAS Number | 40028-29-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(N2CCN(CC2)CCCN)CCC3=CC=CC=C3.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O |
Product Overview
RefChem:1056633 (CAS 40028-29-3), with molecular formula C35H45N3O13 and molecular weight 715.30 g/mol. IUPAC: tris((E)-but-2-enedioic acid);3-[4-[1-(4-methoxyphenyl)-3-phenylpropyl]piperazin-1-yl]propan-1-amine.
Chemical Property Profile of RefChem:1056633
Property Insights of RefChem:1056633
The XLogP value of 2.4709 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1056633. The TPSA of 265.53 Ų indicates high polarity, suggesting RefChem:1056633 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:1056633 has 7 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:1056633?
The CAS number of RefChem:1056633 is 40028-29-3.
What is the molecular formula of RefChem:1056633?
The molecular formula of RefChem:1056633 is C35H45N3O13.
What is the molecular weight of RefChem:1056633?
The molecular weight of RefChem:1056633 is 715.30 g/mol.
Where can I buy RefChem:1056633?
You can request a quote for RefChem:1056633 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1056633?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1056633 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.