1-(Benzylsulfonyl)-4-(5-bromo-2-methoxybenzyl)piperazine
TL;DR: 1-(Benzylsulfonyl)-4-(5-bromo-2-methoxybenzyl)piperazine (CAS 792926-65-9) is a chemical compound with molecular formula C19H23BrN2O3S and molecular weight 438.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzylsulfonyl-4-[(5-bromo-2-methoxyphenyl)methyl]piperazine
Also Known As: 1-(benzylsulfonyl)-4-(5-bromo-2-methoxybenzyl)piperazine, 1-benzylsulfonyl-4-[(5-bromo-2-methoxyphenyl)methyl]piperazine, 1-benzylsulfonyl-4-[(5-bromo-2-methoxy-phenyl)methyl]piperazine
| Molecular Formula | C19H23BrN2O3S |
|---|---|
| Molecular Weight | 438.06 g/mol |
| LogP | 3.1053 |
| Topological Polar Surface Area | 49.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 438.06128 |
| Heavy Atoms | 26 |
| Complexity | 835.1177 |
Chemical Identifiers
| CAS Number | 792926-65-9 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)Br)CN2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3 |
Product Overview
1-(Benzylsulfonyl)-4-(5-bromo-2-methoxybenzyl)piperazine (CAS 792926-65-9), with molecular formula C19H23BrN2O3S and molecular weight 438.06 g/mol. IUPAC: 1-benzylsulfonyl-4-[(5-bromo-2-methoxyphenyl)methyl]piperazine.
Chemical Property Profile of 1-(Benzylsulfonyl)-4-(5-bromo-2-methoxybenzyl)piperazine
Property Insights of 1-(Benzylsulfonyl)-4-(5-bromo-2-methoxybenzyl)piperazine
The XLogP value of 3.1053 indicates that 1-(Benzylsulfonyl)-4-(5-bromo-2-methoxybenzyl)piperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.85 Ų, 1-(Benzylsulfonyl)-4-(5-bromo-2-methoxybenzyl)piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Benzylsulfonyl)-4-(5-bromo-2-methoxybenzyl)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-(Benzylsulfonyl)-4-(5-bromo-2-methoxybenzyl)piperazine?
The CAS number of 1-(Benzylsulfonyl)-4-(5-bromo-2-methoxybenzyl)piperazine is 792926-65-9.
What is the molecular formula of 1-(Benzylsulfonyl)-4-(5-bromo-2-methoxybenzyl)piperazine?
The molecular formula of 1-(Benzylsulfonyl)-4-(5-bromo-2-methoxybenzyl)piperazine is C19H23BrN2O3S.
What is the molecular weight of 1-(Benzylsulfonyl)-4-(5-bromo-2-methoxybenzyl)piperazine?
The molecular weight of 1-(Benzylsulfonyl)-4-(5-bromo-2-methoxybenzyl)piperazine is 438.06 g/mol.
Where can I buy 1-(Benzylsulfonyl)-4-(5-bromo-2-methoxybenzyl)piperazine?
You can request a quote for 1-(Benzylsulfonyl)-4-(5-bromo-2-methoxybenzyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Benzylsulfonyl)-4-(5-bromo-2-methoxybenzyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(Benzylsulfonyl)-4-(5-bromo-2-methoxybenzyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.