1-[3-(Benzyloxy)-4-methoxybenzyl]-4-(4-fluorobenzyl)piperazine
TL;DR: 1-[3-(Benzyloxy)-4-methoxybenzyl]-4-(4-fluorobenzyl)piperazine (CAS 428853-07-0) is a chemical compound with molecular formula C26H29FN2O2 and molecular weight 420.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-fluorophenyl)methyl]-4-[(4-methoxy-3-phenylmethoxyphenyl)methyl]piperazine
Also Known As: 1-[3-(benzyloxy)-4-methoxybenzyl]-4-(4-fluorobenzyl)piperazine, 1-[(4-fluorophenyl)methyl]-4-[(4-methoxy-3-phenylmethoxyphenyl)methyl]piperazine, 1-[(4-fluorophenyl)methyl]-4-[(4-methoxy-3-phenylmethoxy-phenyl)methyl]piperazine
| Molecular Formula | C26H29FN2O2 |
|---|---|
| Molecular Weight | 420.22 g/mol |
| LogP | 4.7311 |
| Topological Polar Surface Area | 24.94 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 420.2213 |
| Heavy Atoms | 31 |
| Complexity | 954.9008 |
Chemical Identifiers
| CAS Number | 428853-07-0 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CN2CCN(CC2)CC3=CC=C(C=C3)F)OCC4=CC=CC=C4 |
Product Overview
1-[3-(Benzyloxy)-4-methoxybenzyl]-4-(4-fluorobenzyl)piperazine (CAS 428853-07-0), with molecular formula C26H29FN2O2 and molecular weight 420.22 g/mol. IUPAC: 1-[(4-fluorophenyl)methyl]-4-[(4-methoxy-3-phenylmethoxyphenyl)methyl]piperazine.
Chemical Property Profile of 1-[3-(Benzyloxy)-4-methoxybenzyl]-4-(4-fluorobenzyl)piperazine
Property Insights of 1-[3-(Benzyloxy)-4-methoxybenzyl]-4-(4-fluorobenzyl)piperazine
The XLogP value of 4.7311 indicates that 1-[3-(Benzyloxy)-4-methoxybenzyl]-4-(4-fluorobenzyl)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-[3-(Benzyloxy)-4-methoxybenzyl]-4-(4-fluorobenzyl)piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[3-(Benzyloxy)-4-methoxybenzyl]-4-(4-fluorobenzyl)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-[3-(Benzyloxy)-4-methoxybenzyl]-4-(4-fluorobenzyl)piperazine?
The CAS number of 1-[3-(Benzyloxy)-4-methoxybenzyl]-4-(4-fluorobenzyl)piperazine is 428853-07-0.
What is the molecular formula of 1-[3-(Benzyloxy)-4-methoxybenzyl]-4-(4-fluorobenzyl)piperazine?
The molecular formula of 1-[3-(Benzyloxy)-4-methoxybenzyl]-4-(4-fluorobenzyl)piperazine is C26H29FN2O2.
What is the molecular weight of 1-[3-(Benzyloxy)-4-methoxybenzyl]-4-(4-fluorobenzyl)piperazine?
The molecular weight of 1-[3-(Benzyloxy)-4-methoxybenzyl]-4-(4-fluorobenzyl)piperazine is 420.22 g/mol.
Where can I buy 1-[3-(Benzyloxy)-4-methoxybenzyl]-4-(4-fluorobenzyl)piperazine?
You can request a quote for 1-[3-(Benzyloxy)-4-methoxybenzyl]-4-(4-fluorobenzyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[3-(Benzyloxy)-4-methoxybenzyl]-4-(4-fluorobenzyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-[3-(Benzyloxy)-4-methoxybenzyl]-4-(4-fluorobenzyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.