4-(4-Methoxyphenyl)-alpha-((2-nitrophenoxy)methyl)-1-piperazineethanol dihydrochloride
TL;DR: 4-(4-Methoxyphenyl)-alpha-((2-nitrophenoxy)methyl)-1-piperazineethanol dihydrochloride (CAS 64511-65-5) is a chemical compound with molecular formula C20H27Cl2N3O5 and molecular weight 459.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-(2-nitrophenoxy)propan-2-ol;dihydrochloride
Also Known As: 4-(4-Methoxyphenyl)-alpha-((2-nitrophenoxy)methyl)-1-piperazineethanol dihydrochloride, 1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-(2-nitrophenoxy)propan-2-ol dihydrochloride, 1-Piperazineethanol, 4-(4-methoxyphenyl)-alpha-((2-nitrophenoxy)methyl)-, dihydrochloride, F1082-0013, 1-(4-(4-methoxyphenyl)piperazin-1-yl)-3-(2-nitrophenoxy)propan-2-ol dihydrochloride
| Molecular Formula | C20H27Cl2N3O5 |
|---|---|
| Molecular Weight | 459.13 g/mol |
| LogP | 3.0089 |
| Topological Polar Surface Area | 88.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 459.13278 |
| Heavy Atoms | 30 |
| Complexity | 786.26636 |
Chemical Identifiers
| CAS Number | 64511-65-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2CCN(CC2)CC(COC3=CC=CC=C3[N+](=O)[O-])O.Cl.Cl |
Product Overview
4-(4-Methoxyphenyl)-alpha-((2-nitrophenoxy)methyl)-1-piperazineethanol dihydrochloride (CAS 64511-65-5), with molecular formula C20H27Cl2N3O5 and molecular weight 459.13 g/mol. IUPAC: 1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-(2-nitrophenoxy)propan-2-ol;dihydrochloride.
Chemical Property Profile of 4-(4-Methoxyphenyl)-alpha-((2-nitrophenoxy)methyl)-1-piperazineethanol dihydrochloride
Property Insights of 4-(4-Methoxyphenyl)-alpha-((2-nitrophenoxy)methyl)-1-piperazineethanol dihydrochloride
The XLogP value of 3.0089 indicates that 4-(4-Methoxyphenyl)-alpha-((2-nitrophenoxy)methyl)-1-piperazineethanol dihydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.31 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-Methoxyphenyl)-alpha-((2-nitrophenoxy)methyl)-1-piperazineethanol dihydrochloride. Following Lipinski's Rule of Five, 4-(4-Methoxyphenyl)-alpha-((2-nitrophenoxy)methyl)-1-piperazineethanol dihydrochloride has 1 hydrogen bond donor(s) and 7 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 4-(4-Methoxyphenyl)-alpha-((2-nitrophenoxy)methyl)-1-piperazineethanol dihydrochloride?
The CAS number of 4-(4-Methoxyphenyl)-alpha-((2-nitrophenoxy)methyl)-1-piperazineethanol dihydrochloride is 64511-65-5.
What is the molecular formula of 4-(4-Methoxyphenyl)-alpha-((2-nitrophenoxy)methyl)-1-piperazineethanol dihydrochloride?
The molecular formula of 4-(4-Methoxyphenyl)-alpha-((2-nitrophenoxy)methyl)-1-piperazineethanol dihydrochloride is C20H27Cl2N3O5.
What is the molecular weight of 4-(4-Methoxyphenyl)-alpha-((2-nitrophenoxy)methyl)-1-piperazineethanol dihydrochloride?
The molecular weight of 4-(4-Methoxyphenyl)-alpha-((2-nitrophenoxy)methyl)-1-piperazineethanol dihydrochloride is 459.13 g/mol.
Where can I buy 4-(4-Methoxyphenyl)-alpha-((2-nitrophenoxy)methyl)-1-piperazineethanol dihydrochloride?
You can request a quote for 4-(4-Methoxyphenyl)-alpha-((2-nitrophenoxy)methyl)-1-piperazineethanol dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-Methoxyphenyl)-alpha-((2-nitrophenoxy)methyl)-1-piperazineethanol dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Methoxyphenyl)-alpha-((2-nitrophenoxy)methyl)-1-piperazineethanol dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.