1-(5-Bromo-2-methoxybenzyl)-4-(2,3-dimethoxybenzoyl)piperazine
TL;DR: 1-(5-Bromo-2-methoxybenzyl)-4-(2,3-dimethoxybenzoyl)piperazine (CAS 423737-95-5) is a chemical compound with molecular formula C21H25BrN2O4 and molecular weight 448.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(5-bromo-2-methoxyphenyl)methyl]piperazin-1-yl]-(2,3-dimethoxyphenyl)methanone
Also Known As: BAS 03050218, AT-057/43313833, 1-(5-bromo-2-methoxybenzyl)-4-(2,3-dimethoxybenzoyl)piperazine, [4-[(5-bromo-2-methoxyphenyl)methyl]piperazin-1-yl]-(2,3-dimethoxyphenyl)methanone, [4-(5-bromo-2-methoxybenzyl)piperazin-1-yl](2,3-dimethoxyphenyl)methanone
| Molecular Formula | C21H25BrN2O4 |
|---|---|
| Molecular Weight | 448.10 g/mol |
| LogP | 3.4329 |
| Topological Polar Surface Area | 51.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 448.09976 |
| Heavy Atoms | 28 |
| Complexity | 835.15045 |
Chemical Identifiers
| CAS Number | 423737-95-5 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)Br)CN2CCN(CC2)C(=O)C3=C(C(=CC=C3)OC)OC |
Product Overview
1-(5-Bromo-2-methoxybenzyl)-4-(2,3-dimethoxybenzoyl)piperazine (CAS 423737-95-5), with molecular formula C21H25BrN2O4 and molecular weight 448.10 g/mol. IUPAC: [4-[(5-bromo-2-methoxyphenyl)methyl]piperazin-1-yl]-(2,3-dimethoxyphenyl)methanone.
Chemical Property Profile of 1-(5-Bromo-2-methoxybenzyl)-4-(2,3-dimethoxybenzoyl)piperazine
Property Insights of 1-(5-Bromo-2-methoxybenzyl)-4-(2,3-dimethoxybenzoyl)piperazine
The XLogP value of 3.4329 indicates that 1-(5-Bromo-2-methoxybenzyl)-4-(2,3-dimethoxybenzoyl)piperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.24 Ų, 1-(5-Bromo-2-methoxybenzyl)-4-(2,3-dimethoxybenzoyl)piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(5-Bromo-2-methoxybenzyl)-4-(2,3-dimethoxybenzoyl)piperazine has 0 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 1-(5-Bromo-2-methoxybenzyl)-4-(2,3-dimethoxybenzoyl)piperazine?
The CAS number of 1-(5-Bromo-2-methoxybenzyl)-4-(2,3-dimethoxybenzoyl)piperazine is 423737-95-5.
What is the molecular formula of 1-(5-Bromo-2-methoxybenzyl)-4-(2,3-dimethoxybenzoyl)piperazine?
The molecular formula of 1-(5-Bromo-2-methoxybenzyl)-4-(2,3-dimethoxybenzoyl)piperazine is C21H25BrN2O4.
What is the molecular weight of 1-(5-Bromo-2-methoxybenzyl)-4-(2,3-dimethoxybenzoyl)piperazine?
The molecular weight of 1-(5-Bromo-2-methoxybenzyl)-4-(2,3-dimethoxybenzoyl)piperazine is 448.10 g/mol.
Where can I buy 1-(5-Bromo-2-methoxybenzyl)-4-(2,3-dimethoxybenzoyl)piperazine?
You can request a quote for 1-(5-Bromo-2-methoxybenzyl)-4-(2,3-dimethoxybenzoyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(5-Bromo-2-methoxybenzyl)-4-(2,3-dimethoxybenzoyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(5-Bromo-2-methoxybenzyl)-4-(2,3-dimethoxybenzoyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.