4-(4-Chlorophenyl)-alpha-((4-nitrophenoxy)methyl)-1-piperazineethanol
TL;DR: 4-(4-Chlorophenyl)-alpha-((4-nitrophenoxy)methyl)-1-piperazineethanol (CAS 64511-36-0) is a chemical compound with molecular formula C19H22ClN3O4 and molecular weight 391.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(4-chlorophenyl)piperazin-1-yl]-3-(4-nitrophenoxy)propan-2-ol
Also Known As: 5-23-02-00122 (Beilstein Handbook Reference), AB00039993-01, 4-(4-Chlorophenyl)-alpha-((4-nitrophenoxy)methyl)-1-piperazineethanol, 1-Piperazineethanol, 4-(4-chlorophenyl)-alpha-((4-nitrophenoxy)methyl)-, 1-[4-(4-chlorophenyl)piperazin-1-yl]-3-(4-nitrophenoxy)propan-2-ol
| Molecular Formula | C19H22ClN3O4 |
|---|---|
| Molecular Weight | 391.13 g/mol |
| LogP | 2.8101 |
| Topological Polar Surface Area | 79.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 391.12988 |
| Heavy Atoms | 27 |
| Complexity | 746.555 |
Chemical Identifiers
| CAS Number | 64511-36-0 |
|---|---|
| SMILES | C1CN(CCN1CC(COC2=CC=C(C=C2)[N+](=O)[O-])O)C3=CC=C(C=C3)Cl |
Product Overview
4-(4-Chlorophenyl)-alpha-((4-nitrophenoxy)methyl)-1-piperazineethanol (CAS 64511-36-0), with molecular formula C19H22ClN3O4 and molecular weight 391.13 g/mol. IUPAC: 1-[4-(4-chlorophenyl)piperazin-1-yl]-3-(4-nitrophenoxy)propan-2-ol.
Chemical Property Profile of 4-(4-Chlorophenyl)-alpha-((4-nitrophenoxy)methyl)-1-piperazineethanol
Property Insights of 4-(4-Chlorophenyl)-alpha-((4-nitrophenoxy)methyl)-1-piperazineethanol
The XLogP value of 2.8101 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-Chlorophenyl)-alpha-((4-nitrophenoxy)methyl)-1-piperazineethanol. The TPSA of 79.08 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-Chlorophenyl)-alpha-((4-nitrophenoxy)methyl)-1-piperazineethanol. Following Lipinski's Rule of Five, 4-(4-Chlorophenyl)-alpha-((4-nitrophenoxy)methyl)-1-piperazineethanol has 1 hydrogen bond donor(s) and 6 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-Chlorophenyl)-alpha-((4-nitrophenoxy)methyl)-1-piperazineethanol?
The CAS number of 4-(4-Chlorophenyl)-alpha-((4-nitrophenoxy)methyl)-1-piperazineethanol is 64511-36-0.
What is the molecular formula of 4-(4-Chlorophenyl)-alpha-((4-nitrophenoxy)methyl)-1-piperazineethanol?
The molecular formula of 4-(4-Chlorophenyl)-alpha-((4-nitrophenoxy)methyl)-1-piperazineethanol is C19H22ClN3O4.
What is the molecular weight of 4-(4-Chlorophenyl)-alpha-((4-nitrophenoxy)methyl)-1-piperazineethanol?
The molecular weight of 4-(4-Chlorophenyl)-alpha-((4-nitrophenoxy)methyl)-1-piperazineethanol is 391.13 g/mol.
Where can I buy 4-(4-Chlorophenyl)-alpha-((4-nitrophenoxy)methyl)-1-piperazineethanol?
You can request a quote for 4-(4-Chlorophenyl)-alpha-((4-nitrophenoxy)methyl)-1-piperazineethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-Chlorophenyl)-alpha-((4-nitrophenoxy)methyl)-1-piperazineethanol?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Chlorophenyl)-alpha-((4-nitrophenoxy)methyl)-1-piperazineethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.