4-Benzyl-1-piperazineethanol
TL;DR: 4-Benzyl-1-piperazineethanol (CAS 3221-20-3) is a chemical compound with molecular formula C13H20N2O and molecular weight 220.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-benzylpiperazin-1-yl)ethanol
Also Known As: 4-benzyl-1-piperazineethanol, 2-(4-Benzyl-piperazin-1-yl)-ethanol, 2-(4-benzylpiperazin-1-yl)ethanol, 2-(4-benzylpiperazin-1-yl)ethan-1-ol, 4-(phenylmethyl)-1-Piperazineethanol
| Molecular Formula | C13H20N2O |
|---|---|
| Molecular Weight | 220.16 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 26.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 220.15756 |
| Heavy Atoms | 16 |
| Complexity | 184.0 |
Chemical Identifiers
| CAS Number | 3221-20-3 |
|---|---|
| SMILES | C1CN(CCN1CCO)CC2=CC=CC=C2 |
| InChIKey | VIRUORUIOHJCOD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Benzyl-1-piperazineethanol (CAS 3221-20-3), with molecular formula C13H20N2O and molecular weight 220.16 g/mol. IUPAC: 2-(4-benzylpiperazin-1-yl)ethanol.
Chemical Property Profile of 4-Benzyl-1-piperazineethanol
Property Insights of 4-Benzyl-1-piperazineethanol
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Benzyl-1-piperazineethanol. With a topological polar surface area (TPSA) of 26.7 Ų, 4-Benzyl-1-piperazineethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Benzyl-1-piperazineethanol has 1 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 4-Benzyl-1-piperazineethanol?
The CAS number of 4-Benzyl-1-piperazineethanol is 3221-20-3.
What is the molecular formula of 4-Benzyl-1-piperazineethanol?
The molecular formula of 4-Benzyl-1-piperazineethanol is C13H20N2O.
What is the molecular weight of 4-Benzyl-1-piperazineethanol?
The molecular weight of 4-Benzyl-1-piperazineethanol is 220.16 g/mol.
Where can I buy 4-Benzyl-1-piperazineethanol?
You can request a quote for 4-Benzyl-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-Benzyl-1-piperazineethanol?
Yes, KEHONG BIO provides custom synthesis services for 4-Benzyl-1-piperazineethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.