Phenol, o-(4-(3,4-dimethoxyphenethyl)-1-piperazinyl)-
TL;DR: Phenol, o-(4-(3,4-dimethoxyphenethyl)-1-piperazinyl)- (CAS 1049-81-6) is a chemical compound with molecular formula C20H26N2O3 and molecular weight 342.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[2-(3,4-dimethoxyphenyl)ethyl]piperazin-1-yl]phenol
Also Known As: Phenol, o-(4-(3,4-dimethoxyphenethyl)-1-piperazinyl)-, o-(4-(3,4-Dimethoxyphenethyl)-1-piperazinyl)phenol, 5-23-02-00162 (Beilstein Handbook Reference), 2-[4-(3,4-Dimethoxyphenethyl)-1-piperazinyl]phenol, 2-{4-[2-(3,4-dimethoxyphenyl)ethyl]piperazin-1-yl}phenol
| Molecular Formula | C20H26N2O3 |
|---|---|
| Molecular Weight | 342.19 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 45.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 342.19434 |
| Heavy Atoms | 25 |
| Complexity | 387.0 |
Chemical Identifiers
| CAS Number | 1049-81-6 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCN2CCN(CC2)C3=CC=CC=C3O)OC |
| InChIKey | COUBFHDRVMCGBX-UHFFFAOYSA-N |
Product Overview
Phenol, o-(4-(3,4-dimethoxyphenethyl)-1-piperazinyl)- (CAS 1049-81-6), with molecular formula C20H26N2O3 and molecular weight 342.19 g/mol. IUPAC: 2-[4-[2-(3,4-dimethoxyphenyl)ethyl]piperazin-1-yl]phenol.
Chemical Property Profile of Phenol, o-(4-(3,4-dimethoxyphenethyl)-1-piperazinyl)-
Property Insights of Phenol, o-(4-(3,4-dimethoxyphenethyl)-1-piperazinyl)-
The XLogP value of 3.4 indicates that Phenol, o-(4-(3,4-dimethoxyphenethyl)-1-piperazinyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.2 Ų, Phenol, o-(4-(3,4-dimethoxyphenethyl)-1-piperazinyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenol, o-(4-(3,4-dimethoxyphenethyl)-1-piperazinyl)- has 1 hydrogen bond donor(s) and 5 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 Phenol, o-(4-(3,4-dimethoxyphenethyl)-1-piperazinyl)-?
The CAS number of Phenol, o-(4-(3,4-dimethoxyphenethyl)-1-piperazinyl)- is 1049-81-6.
What is the molecular formula of Phenol, o-(4-(3,4-dimethoxyphenethyl)-1-piperazinyl)-?
The molecular formula of Phenol, o-(4-(3,4-dimethoxyphenethyl)-1-piperazinyl)- is C20H26N2O3.
What is the molecular weight of Phenol, o-(4-(3,4-dimethoxyphenethyl)-1-piperazinyl)-?
The molecular weight of Phenol, o-(4-(3,4-dimethoxyphenethyl)-1-piperazinyl)- is 342.19 g/mol.
Where can I buy Phenol, o-(4-(3,4-dimethoxyphenethyl)-1-piperazinyl)-?
You can request a quote for Phenol, o-(4-(3,4-dimethoxyphenethyl)-1-piperazinyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenol, o-(4-(3,4-dimethoxyphenethyl)-1-piperazinyl)-?
Yes, KEHONG BIO provides custom synthesis services for Phenol, o-(4-(3,4-dimethoxyphenethyl)-1-piperazinyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.