1-(1,3-Benzodioxol-5-ylmethyl)-4-(4-bromobenzyl)piperazine
TL;DR: 1-(1,3-Benzodioxol-5-ylmethyl)-4-(4-bromobenzyl)piperazine (CAS 355396-68-8) is a chemical compound with molecular formula C19H21BrN2O2 and molecular weight 388.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1,3-benzodioxol-5-ylmethyl)-4-[(4-bromophenyl)methyl]piperazine
Also Known As: BAS 01840661, 1-(1,3-benzodioxol-5-ylmethyl)-4-(4-bromobenzyl)piperazine, 1-(1,3-benzodioxol-5-ylmethyl)-4-[(4-bromophenyl)methyl]piperazine, 1-Benzo[1,3]dioxol-5-ylmethyl-4-(4-bromo-benzyl)-piperazine, 1-(benzo[d][1,3]dioxol-5-ylmethyl)-4-(4-bromobenzyl)piperazine
| Molecular Formula | C19H21BrN2O2 |
|---|---|
| Molecular Weight | 388.08 g/mol |
| LogP | 3.4956 |
| Topological Polar Surface Area | 24.94 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 388.07864 |
| Heavy Atoms | 24 |
| Complexity | 697.013 |
Chemical Identifiers
| CAS Number | 355396-68-8 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC=C(C=C2)Br)CC3=CC4=C(C=C3)OCO4 |
Product Overview
1-(1,3-Benzodioxol-5-ylmethyl)-4-(4-bromobenzyl)piperazine (CAS 355396-68-8), with molecular formula C19H21BrN2O2 and molecular weight 388.08 g/mol. IUPAC: 1-(1,3-benzodioxol-5-ylmethyl)-4-[(4-bromophenyl)methyl]piperazine.
Chemical Property Profile of 1-(1,3-Benzodioxol-5-ylmethyl)-4-(4-bromobenzyl)piperazine
Property Insights of 1-(1,3-Benzodioxol-5-ylmethyl)-4-(4-bromobenzyl)piperazine
The XLogP value of 3.4956 indicates that 1-(1,3-Benzodioxol-5-ylmethyl)-4-(4-bromobenzyl)piperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.94 Ų, 1-(1,3-Benzodioxol-5-ylmethyl)-4-(4-bromobenzyl)piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1,3-Benzodioxol-5-ylmethyl)-4-(4-bromobenzyl)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-(1,3-Benzodioxol-5-ylmethyl)-4-(4-bromobenzyl)piperazine?
The CAS number of 1-(1,3-Benzodioxol-5-ylmethyl)-4-(4-bromobenzyl)piperazine is 355396-68-8.
What is the molecular formula of 1-(1,3-Benzodioxol-5-ylmethyl)-4-(4-bromobenzyl)piperazine?
The molecular formula of 1-(1,3-Benzodioxol-5-ylmethyl)-4-(4-bromobenzyl)piperazine is C19H21BrN2O2.
What is the molecular weight of 1-(1,3-Benzodioxol-5-ylmethyl)-4-(4-bromobenzyl)piperazine?
The molecular weight of 1-(1,3-Benzodioxol-5-ylmethyl)-4-(4-bromobenzyl)piperazine is 388.08 g/mol.
Where can I buy 1-(1,3-Benzodioxol-5-ylmethyl)-4-(4-bromobenzyl)piperazine?
You can request a quote for 1-(1,3-Benzodioxol-5-ylmethyl)-4-(4-bromobenzyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1,3-Benzodioxol-5-ylmethyl)-4-(4-bromobenzyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(1,3-Benzodioxol-5-ylmethyl)-4-(4-bromobenzyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.