1-(p-tert-Butylbenzyl)-4-(2-(alpha-(p-chlorophenyl)benzylamino)ethyl)piperazine dimaleate
TL;DR: 1-(p-tert-Butylbenzyl)-4-(2-(alpha-(p-chlorophenyl)benzylamino)ethyl)piperazine dimaleate (CAS 22662-91-5) is a chemical compound with molecular formula C38H46ClN3O8 and molecular weight 707.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis((Z)-but-2-enedioic acid);2-[4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]-N-[(4-chlorophenyl)-phenylmethyl]ethanamine
Also Known As: 1-(p-tert-Butylbenzyl)-4-(2-(alpha-(p-chlorophenyl)benzylamino)ethyl)piperazine dimaleate, Piperazine, 1-(p-tert-butylbenzyl)-4-(2-(alpha-(p-chlorophenyl)benzylamino)ethyl)-, dimaleate, (Z)-but-2-enedioic acid; 2-[4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]-N-[(4-chlorophenyl)-phenylmethyl]ethanamine, 1-Piperazineethanamine, N-[(4-chlorophenyl)phenylmethyl]-4-[[4-(1,1-dimethylethyl)phenyl]methyl]-, (Z)-2-butenedioate (1:2), Piperazine, 1-(p-tert-butylbenzyl)-4-[2-[(p-chloro-.alpha.-phenylbenzyl)amino]ethyl]-, maleate (1:2) (salt)
| Molecular Formula | C38H46ClN3O8 |
|---|---|
| Molecular Weight | 707.30 g/mol |
| LogP | 5.5579 |
| Topological Polar Surface Area | 167.71 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 12 |
| Exact Mass | 707.29736 |
| Heavy Atoms | 50 |
| Complexity | 1496.2881 |
Chemical Identifiers
| CAS Number | 22662-91-5 |
|---|---|
| SMILES | CC(C1=CC=C(C=C1)CN2CCN(CC2)CCNC(C3=CC=C(C=C3)Cl)C4=CC=CC=C4)(C)C.C(=C\C(=O)O)\C(=O)O.C(=C\C(=O)O)\C(=O)O |
Product Overview
1-(p-tert-Butylbenzyl)-4-(2-(alpha-(p-chlorophenyl)benzylamino)ethyl)piperazine dimaleate (CAS 22662-91-5), with molecular formula C38H46ClN3O8 and molecular weight 707.30 g/mol. IUPAC: bis((Z)-but-2-enedioic acid);2-[4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]-N-[(4-chlorophenyl)-phenylmethyl]ethanamine.
Chemical Property Profile of 1-(p-tert-Butylbenzyl)-4-(2-(alpha-(p-chlorophenyl)benzylamino)ethyl)piperazine dimaleate
Property Insights of 1-(p-tert-Butylbenzyl)-4-(2-(alpha-(p-chlorophenyl)benzylamino)ethyl)piperazine dimaleate
The XLogP value of 5.5579 indicates that 1-(p-tert-Butylbenzyl)-4-(2-(alpha-(p-chlorophenyl)benzylamino)ethyl)piperazine dimaleate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 167.71 Ų indicates high polarity, suggesting 1-(p-tert-Butylbenzyl)-4-(2-(alpha-(p-chlorophenyl)benzylamino)ethyl)piperazine dimaleate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-(p-tert-Butylbenzyl)-4-(2-(alpha-(p-chlorophenyl)benzylamino)ethyl)piperazine dimaleate 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 1-(p-tert-Butylbenzyl)-4-(2-(alpha-(p-chlorophenyl)benzylamino)ethyl)piperazine dimaleate?
The CAS number of 1-(p-tert-Butylbenzyl)-4-(2-(alpha-(p-chlorophenyl)benzylamino)ethyl)piperazine dimaleate is 22662-91-5.
What is the molecular formula of 1-(p-tert-Butylbenzyl)-4-(2-(alpha-(p-chlorophenyl)benzylamino)ethyl)piperazine dimaleate?
The molecular formula of 1-(p-tert-Butylbenzyl)-4-(2-(alpha-(p-chlorophenyl)benzylamino)ethyl)piperazine dimaleate is C38H46ClN3O8.
What is the molecular weight of 1-(p-tert-Butylbenzyl)-4-(2-(alpha-(p-chlorophenyl)benzylamino)ethyl)piperazine dimaleate?
The molecular weight of 1-(p-tert-Butylbenzyl)-4-(2-(alpha-(p-chlorophenyl)benzylamino)ethyl)piperazine dimaleate is 707.30 g/mol.
Where can I buy 1-(p-tert-Butylbenzyl)-4-(2-(alpha-(p-chlorophenyl)benzylamino)ethyl)piperazine dimaleate?
You can request a quote for 1-(p-tert-Butylbenzyl)-4-(2-(alpha-(p-chlorophenyl)benzylamino)ethyl)piperazine dimaleate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(p-tert-Butylbenzyl)-4-(2-(alpha-(p-chlorophenyl)benzylamino)ethyl)piperazine dimaleate?
Yes, KEHONG BIO provides custom synthesis services for 1-(p-tert-Butylbenzyl)-4-(2-(alpha-(p-chlorophenyl)benzylamino)ethyl)piperazine dimaleate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.