1-(2,3-Dimethoxybenzyl)-4-(phenylacetyl)piperazine
TL;DR: 1-(2,3-Dimethoxybenzyl)-4-(phenylacetyl)piperazine (CAS 462095-36-9) is a chemical compound with molecular formula C21H26N2O3 and molecular weight 354.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-[(2,3-dimethoxyphenyl)methyl]piperazin-1-yl]-2-phenylethanone
Also Known As: BAS 04057385, BIM-0009754.P001, 1-(2,3-dimethoxybenzyl)-4-(phenylacetyl)piperazine, AT-057/43318725, 1-[4-[(2,3-dimethoxyphenyl)methyl]piperazin-1-yl]-2-phenylethanone
| Molecular Formula | C21H26N2O3 |
|---|---|
| Molecular Weight | 354.19 g/mol |
| LogP | 2.5907 |
| Topological Polar Surface Area | 42.01 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 354.19434 |
| Heavy Atoms | 26 |
| Complexity | 725.29095 |
Chemical Identifiers
| CAS Number | 462095-36-9 |
|---|---|
| SMILES | COC1=CC=CC(=C1OC)CN2CCN(CC2)C(=O)CC3=CC=CC=C3 |
Product Overview
1-(2,3-Dimethoxybenzyl)-4-(phenylacetyl)piperazine (CAS 462095-36-9), with molecular formula C21H26N2O3 and molecular weight 354.19 g/mol. IUPAC: 1-[4-[(2,3-dimethoxyphenyl)methyl]piperazin-1-yl]-2-phenylethanone.
Chemical Property Profile of 1-(2,3-Dimethoxybenzyl)-4-(phenylacetyl)piperazine
Property Insights of 1-(2,3-Dimethoxybenzyl)-4-(phenylacetyl)piperazine
The XLogP value of 2.5907 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2,3-Dimethoxybenzyl)-4-(phenylacetyl)piperazine. With a topological polar surface area (TPSA) of 42.01 Ų, 1-(2,3-Dimethoxybenzyl)-4-(phenylacetyl)piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2,3-Dimethoxybenzyl)-4-(phenylacetyl)piperazine has 0 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-Dimethoxybenzyl)-4-(phenylacetyl)piperazine?
The CAS number of 1-(2,3-Dimethoxybenzyl)-4-(phenylacetyl)piperazine is 462095-36-9.
What is the molecular formula of 1-(2,3-Dimethoxybenzyl)-4-(phenylacetyl)piperazine?
The molecular formula of 1-(2,3-Dimethoxybenzyl)-4-(phenylacetyl)piperazine is C21H26N2O3.
What is the molecular weight of 1-(2,3-Dimethoxybenzyl)-4-(phenylacetyl)piperazine?
The molecular weight of 1-(2,3-Dimethoxybenzyl)-4-(phenylacetyl)piperazine is 354.19 g/mol.
Where can I buy 1-(2,3-Dimethoxybenzyl)-4-(phenylacetyl)piperazine?
You can request a quote for 1-(2,3-Dimethoxybenzyl)-4-(phenylacetyl)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-Dimethoxybenzyl)-4-(phenylacetyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,3-Dimethoxybenzyl)-4-(phenylacetyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.