Piperazine, 1-benzyl-4-(2-(bis(2-chloroethyl)amino)ethyl)-, trihydrochloride
TL;DR: Piperazine, 1-benzyl-4-(2-(bis(2-chloroethyl)amino)ethyl)-, trihydrochloride (CAS 93868-40-7) is a chemical compound with molecular formula C17H30Cl5N3 and molecular weight 451.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-benzylpiperazin-1-yl)-N,N-bis(2-chloroethyl)ethanamine;trihydrochloride
Also Known As: Piperazine, 1-benzyl-4-(2-(bis(2-chloroethyl)amino)ethyl)-, trihydrochloride, 1-Benzyl-4-(2-(bis(2-chloroethyl)amino)ethyl)piperazine trihydrochloride, 2-(4-Benzylpiperazin-1-yl)-N,N-bis(2-chloroethyl)ethan-1-amine--hydrogen chloride (1/3), 2-(4-benzylpiperazin-1-yl)-N,N-bis(2-chloroethyl)ethanamine trihydrochloride, RefChem:372550
| Molecular Formula | C17H30Cl5N3 |
|---|---|
| Molecular Weight | 451.09 g/mol |
| LogP | 3.8492 |
| Topological Polar Surface Area | 9.72 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 451.08823 |
| Heavy Atoms | 25 |
| Complexity | 396.5296 |
Chemical Identifiers
| CAS Number | 93868-40-7 |
|---|---|
| SMILES | C1CN(CCN1CCN(CCCl)CCCl)CC2=CC=CC=C2.Cl.Cl.Cl |
Product Overview
Piperazine, 1-benzyl-4-(2-(bis(2-chloroethyl)amino)ethyl)-, trihydrochloride (CAS 93868-40-7), with molecular formula C17H30Cl5N3 and molecular weight 451.09 g/mol. IUPAC: 2-(4-benzylpiperazin-1-yl)-N,N-bis(2-chloroethyl)ethanamine;trihydrochloride.
Chemical Property Profile of Piperazine, 1-benzyl-4-(2-(bis(2-chloroethyl)amino)ethyl)-, trihydrochloride
Property Insights of Piperazine, 1-benzyl-4-(2-(bis(2-chloroethyl)amino)ethyl)-, trihydrochloride
The XLogP value of 3.8492 indicates that Piperazine, 1-benzyl-4-(2-(bis(2-chloroethyl)amino)ethyl)-, trihydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.72 Ų, Piperazine, 1-benzyl-4-(2-(bis(2-chloroethyl)amino)ethyl)-, trihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Piperazine, 1-benzyl-4-(2-(bis(2-chloroethyl)amino)ethyl)-, trihydrochloride has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Piperazine, 1-benzyl-4-(2-(bis(2-chloroethyl)amino)ethyl)-, trihydrochloride?
The CAS number of Piperazine, 1-benzyl-4-(2-(bis(2-chloroethyl)amino)ethyl)-, trihydrochloride is 93868-40-7.
What is the molecular formula of Piperazine, 1-benzyl-4-(2-(bis(2-chloroethyl)amino)ethyl)-, trihydrochloride?
The molecular formula of Piperazine, 1-benzyl-4-(2-(bis(2-chloroethyl)amino)ethyl)-, trihydrochloride is C17H30Cl5N3.
What is the molecular weight of Piperazine, 1-benzyl-4-(2-(bis(2-chloroethyl)amino)ethyl)-, trihydrochloride?
The molecular weight of Piperazine, 1-benzyl-4-(2-(bis(2-chloroethyl)amino)ethyl)-, trihydrochloride is 451.09 g/mol.
Where can I buy Piperazine, 1-benzyl-4-(2-(bis(2-chloroethyl)amino)ethyl)-, trihydrochloride?
You can request a quote for Piperazine, 1-benzyl-4-(2-(bis(2-chloroethyl)amino)ethyl)-, trihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Piperazine, 1-benzyl-4-(2-(bis(2-chloroethyl)amino)ethyl)-, trihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Piperazine, 1-benzyl-4-(2-(bis(2-chloroethyl)amino)ethyl)-, trihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.