N-(1-Methyl-2-(4-phenethylpiperazino)ethyl)propionanilide oxalate (1:2)
TL;DR: N-(1-Methyl-2-(4-phenethylpiperazino)ethyl)propionanilide oxalate (1:2) (CAS 77563-02-1) is a chemical compound with molecular formula C28H37N3O9 and molecular weight 559.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
oxalic acid;N-phenyl-N-[1-[4-(2-phenylethyl)piperazin-1-yl]propan-2-yl]propanamide
Also Known As: N-(1-Methyl-2-(4-phenethylpiperazino)ethyl)propionanilide oxalate (1:2), Propanamide, N-(1-methyl-2-(4-(2-phenylethyl)-1-piperazinyl)ethyl)-N-phenyl-, ethanedioate (1:2), Oxalic acid--N-phenyl-N-{1-[4-(2-phenylethyl)piperazin-1-yl]propan-2-yl}propanamide (2/1), oxalic acid; N-[1-(4-phenethylpiperazin-1-yl)propan-2-yl]-N-phenylpropanamide, RefChem:374136
| Molecular Formula | C28H37N3O9 |
|---|---|
| Molecular Weight | 559.25 g/mol |
| LogP | 1.9896 |
| Topological Polar Surface Area | 175.99 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 559.253 |
| Heavy Atoms | 40 |
| Complexity | 1040.7189 |
Chemical Identifiers
| CAS Number | 77563-02-1 |
|---|---|
| SMILES | CCC(=O)N(C1=CC=CC=C1)C(C)CN2CCN(CC2)CCC3=CC=CC=C3.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O |
Product Overview
N-(1-Methyl-2-(4-phenethylpiperazino)ethyl)propionanilide oxalate (1:2) (CAS 77563-02-1), with molecular formula C28H37N3O9 and molecular weight 559.25 g/mol. IUPAC: oxalic acid;N-phenyl-N-[1-[4-(2-phenylethyl)piperazin-1-yl]propan-2-yl]propanamide.
Chemical Property Profile of N-(1-Methyl-2-(4-phenethylpiperazino)ethyl)propionanilide oxalate (1:2)
Property Insights of N-(1-Methyl-2-(4-phenethylpiperazino)ethyl)propionanilide oxalate (1:2)
The XLogP value of 1.9896 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1-Methyl-2-(4-phenethylpiperazino)ethyl)propionanilide oxalate (1:2). The TPSA of 175.99 Ų indicates high polarity, suggesting N-(1-Methyl-2-(4-phenethylpiperazino)ethyl)propionanilide oxalate (1:2) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-(1-Methyl-2-(4-phenethylpiperazino)ethyl)propionanilide oxalate (1:2) 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 N-(1-Methyl-2-(4-phenethylpiperazino)ethyl)propionanilide oxalate (1:2)?
The CAS number of N-(1-Methyl-2-(4-phenethylpiperazino)ethyl)propionanilide oxalate (1:2) is 77563-02-1.
What is the molecular formula of N-(1-Methyl-2-(4-phenethylpiperazino)ethyl)propionanilide oxalate (1:2)?
The molecular formula of N-(1-Methyl-2-(4-phenethylpiperazino)ethyl)propionanilide oxalate (1:2) is C28H37N3O9.
What is the molecular weight of N-(1-Methyl-2-(4-phenethylpiperazino)ethyl)propionanilide oxalate (1:2)?
The molecular weight of N-(1-Methyl-2-(4-phenethylpiperazino)ethyl)propionanilide oxalate (1:2) is 559.25 g/mol.
Where can I buy N-(1-Methyl-2-(4-phenethylpiperazino)ethyl)propionanilide oxalate (1:2)?
You can request a quote for N-(1-Methyl-2-(4-phenethylpiperazino)ethyl)propionanilide oxalate (1:2) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1-Methyl-2-(4-phenethylpiperazino)ethyl)propionanilide oxalate (1:2)?
Yes, KEHONG BIO provides custom synthesis services for N-(1-Methyl-2-(4-phenethylpiperazino)ethyl)propionanilide oxalate (1:2) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.