![1-[(2,3-Dimethoxyphenyl)methyl]piperazine structure](/static/products/1587/158776-75-1.webp)
1-[(2,3-Dimethoxyphenyl)methyl]piperazine
TL;DR: 1-[(2,3-Dimethoxyphenyl)methyl]piperazine (CAS 158776-75-1) is a chemical compound with molecular formula C13H20N2O2 and molecular weight 236.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2,3-dimethoxyphenyl)methyl]piperazine
Also Known As: 1-(2,3-dimethoxybenzyl)piperazine, 1-[(2,3-dimethoxyphenyl)methyl]piperazine, 1-(2,3-Dimethoxy-benzyl)-piperazine, BAS 01234895, 2-methoxy-3-(piperazin-1-ylmethyl)phenol
| Molecular Formula | C13H20N2O2 |
|---|---|
| Molecular Weight | 236.15 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 33.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 236.15248 |
| Heavy Atoms | 17 |
| Complexity | 219.0 |
Chemical Identifiers
| CAS Number | 158776-75-1 |
|---|---|
| SMILES | COC1=CC=CC(=C1OC)CN2CCNCC2 |
| InChIKey | RHKQXCFGQFIGNO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-[(2,3-Dimethoxyphenyl)methyl]piperazine (CAS 158776-75-1), with molecular formula C13H20N2O2 and molecular weight 236.15 g/mol. IUPAC: 1-[(2,3-dimethoxyphenyl)methyl]piperazine.
Chemical Property Profile of 1-[(2,3-Dimethoxyphenyl)methyl]piperazine
Property Insights of 1-[(2,3-Dimethoxyphenyl)methyl]piperazine
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(2,3-Dimethoxyphenyl)methyl]piperazine. With a topological polar surface area (TPSA) of 33.7 Ų, 1-[(2,3-Dimethoxyphenyl)methyl]piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(2,3-Dimethoxyphenyl)methyl]piperazine has 1 hydrogen bond donor(s) and 4 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 1-[(2,3-Dimethoxyphenyl)methyl]piperazine?
The CAS number of 1-[(2,3-Dimethoxyphenyl)methyl]piperazine is 158776-75-1.
What is the molecular formula of 1-[(2,3-Dimethoxyphenyl)methyl]piperazine?
The molecular formula of 1-[(2,3-Dimethoxyphenyl)methyl]piperazine is C13H20N2O2.
What is the molecular weight of 1-[(2,3-Dimethoxyphenyl)methyl]piperazine?
The molecular weight of 1-[(2,3-Dimethoxyphenyl)methyl]piperazine is 236.15 g/mol.
Where can I buy 1-[(2,3-Dimethoxyphenyl)methyl]piperazine?
You can request a quote for 1-[(2,3-Dimethoxyphenyl)methyl]piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(2,3-Dimethoxyphenyl)methyl]piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-[(2,3-Dimethoxyphenyl)methyl]piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.