RefChem:1095836
TL;DR: RefChem:1095836 (CAS 23941-06-2) is a chemical compound with molecular formula C30H37ClN2O9 and molecular weight 604.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis((Z)-but-2-enedioic acid);1-[4-[3-(4-chlorophenyl)-3-phenylpropyl]piperazin-1-yl]propan-2-ol
Also Known As: 1-(3-(p-Chlorophenyl)-3-phenylpropyl)-4-(2-hydroxypropyl)piperazine dimaleate, Piperazine, 1-(3-(p-chlorophenyl)-3-phenylpropyl)-4-(2-hydroxypropyl)-, dimaleate, 1-Piperazineethanol, 4-[3-(p-chlorophenyl)-3-phenylpropyl]-.alpha.-methyl-, maleate (1:2), (Z)-but-2-enedioic acid; 1-[4-[3-(4-chlorophenyl)-3-phenylpropyl]piperazin-1-yl]propan-2-ol, RefChem:1095836
| Molecular Formula | C30H37ClN2O9 |
|---|---|
| Molecular Weight | 604.22 g/mol |
| LogP | 3.284 |
| Topological Polar Surface Area | 175.91 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 604.21875 |
| Heavy Atoms | 42 |
| Complexity | 1111.0256 |
Chemical Identifiers
| CAS Number | 23941-06-2 |
|---|---|
| SMILES | CC(O)CN1CCN(CC1)CCC(C2=CC=C(C=C2)Cl)C3=CC=CC=C3.C(=C\C(=O)O)\C(=O)O.C(=C\C(=O)O)\C(=O)O |
Product Overview
RefChem:1095836 (CAS 23941-06-2), with molecular formula C30H37ClN2O9 and molecular weight 604.22 g/mol. IUPAC: bis((Z)-but-2-enedioic acid);1-[4-[3-(4-chlorophenyl)-3-phenylpropyl]piperazin-1-yl]propan-2-ol.
Chemical Property Profile of RefChem:1095836
Property Insights of RefChem:1095836
The XLogP value of 3.284 indicates that RefChem:1095836 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 175.91 Ų indicates high polarity, suggesting RefChem:1095836 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:1095836 has 5 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:1095836?
The CAS number of RefChem:1095836 is 23941-06-2.
What is the molecular formula of RefChem:1095836?
The molecular formula of RefChem:1095836 is C30H37ClN2O9.
What is the molecular weight of RefChem:1095836?
The molecular weight of RefChem:1095836 is 604.22 g/mol.
Where can I buy RefChem:1095836?
You can request a quote for RefChem:1095836 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1095836?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1095836 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.