4-Benzyl-1-(4-(2-(benzyloxy)ethoxy)-4-methylhex-2-yn-1-yl)piperidine
TL;DR: 4-Benzyl-1-(4-(2-(benzyloxy)ethoxy)-4-methylhex-2-yn-1-yl)piperidine (CAS 698389-86-5) is a chemical compound with molecular formula C28H37NO2 and molecular weight 419.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-benzyl-1-[4-methyl-4-(2-phenylmethoxyethoxy)hex-2-ynyl]piperidine
Also Known As: 4-benzyl-1-[4-methyl-4-(2-phenylmethoxyethoxy)hex-2-ynyl]piperidine, 4-benzyl-1-(4-(2-(benzyloxy)ethoxy)-4-methylhex-2-yn-1-yl)piperidine, 4-benzyl-1-{4-[2-(benzyloxy)ethoxy]-4-methylhex-2-yn-1-yl}piperidine
| Molecular Formula | C28H37NO2 |
|---|---|
| Molecular Weight | 419.28 g/mol |
| LogP | 5.3466 |
| Topological Polar Surface Area | 21.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 419.28244 |
| Heavy Atoms | 31 |
| Complexity | 803.1561 |
Chemical Identifiers
| CAS Number | 698389-86-5 |
|---|---|
| SMILES | CCC(C)(C#CCN1CCC(CC1)CC2=CC=CC=C2)OCCOCC3=CC=CC=C3 |
Product Overview
4-Benzyl-1-(4-(2-(benzyloxy)ethoxy)-4-methylhex-2-yn-1-yl)piperidine (CAS 698389-86-5), with molecular formula C28H37NO2 and molecular weight 419.28 g/mol. IUPAC: 4-benzyl-1-[4-methyl-4-(2-phenylmethoxyethoxy)hex-2-ynyl]piperidine.
Chemical Property Profile of 4-Benzyl-1-(4-(2-(benzyloxy)ethoxy)-4-methylhex-2-yn-1-yl)piperidine
Property Insights of 4-Benzyl-1-(4-(2-(benzyloxy)ethoxy)-4-methylhex-2-yn-1-yl)piperidine
The XLogP value of 5.3466 indicates that 4-Benzyl-1-(4-(2-(benzyloxy)ethoxy)-4-methylhex-2-yn-1-yl)piperidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.7 Ų, 4-Benzyl-1-(4-(2-(benzyloxy)ethoxy)-4-methylhex-2-yn-1-yl)piperidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Benzyl-1-(4-(2-(benzyloxy)ethoxy)-4-methylhex-2-yn-1-yl)piperidine has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-Benzyl-1-(4-(2-(benzyloxy)ethoxy)-4-methylhex-2-yn-1-yl)piperidine?
The CAS number of 4-Benzyl-1-(4-(2-(benzyloxy)ethoxy)-4-methylhex-2-yn-1-yl)piperidine is 698389-86-5.
What is the molecular formula of 4-Benzyl-1-(4-(2-(benzyloxy)ethoxy)-4-methylhex-2-yn-1-yl)piperidine?
The molecular formula of 4-Benzyl-1-(4-(2-(benzyloxy)ethoxy)-4-methylhex-2-yn-1-yl)piperidine is C28H37NO2.
What is the molecular weight of 4-Benzyl-1-(4-(2-(benzyloxy)ethoxy)-4-methylhex-2-yn-1-yl)piperidine?
The molecular weight of 4-Benzyl-1-(4-(2-(benzyloxy)ethoxy)-4-methylhex-2-yn-1-yl)piperidine is 419.28 g/mol.
Where can I buy 4-Benzyl-1-(4-(2-(benzyloxy)ethoxy)-4-methylhex-2-yn-1-yl)piperidine?
You can request a quote for 4-Benzyl-1-(4-(2-(benzyloxy)ethoxy)-4-methylhex-2-yn-1-yl)piperidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Benzyl-1-(4-(2-(benzyloxy)ethoxy)-4-methylhex-2-yn-1-yl)piperidine?
Yes, KEHONG BIO provides custom synthesis services for 4-Benzyl-1-(4-(2-(benzyloxy)ethoxy)-4-methylhex-2-yn-1-yl)piperidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.