1'-(4-Nitrobenzyl)-1,4'-bipiperidine oxalate
TL;DR: 1'-(4-Nitrobenzyl)-1,4'-bipiperidine oxalate (CAS 337489-26-6) is a chemical compound with molecular formula C17H25N3O2 and molecular weight 303.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-nitrophenyl)methyl]-4-piperidin-1-ylpiperidine
Also Known As: BAS 01313291, 1-(4-nitrobenzyl)-1',4-bipiperidine, 1'-(4-nitrobenzyl)-1,4'-bipiperidine, 1'-(4-nitrobenzyl)-1,4'-bipiperidine oxalate, 1'-(4-Nitro-benzyl)-[1,4']bipiperidinyl
| Molecular Formula | C17H25N3O2 |
|---|---|
| Molecular Weight | 303.19 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 52.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 303.19467 |
| Heavy Atoms | 22 |
| Complexity | 349.0 |
Chemical Identifiers
| CAS Number | 337489-26-6 |
|---|---|
| SMILES | C1CCN(CC1)C2CCN(CC2)CC3=CC=C(C=C3)[N+](=O)[O-] |
| InChIKey | GXURWRJBLAJNHS-UHFFFAOYSA-N |
Product Overview
1'-(4-Nitrobenzyl)-1,4'-bipiperidine oxalate (CAS 337489-26-6), with molecular formula C17H25N3O2 and molecular weight 303.19 g/mol. IUPAC: 1-[(4-nitrophenyl)methyl]-4-piperidin-1-ylpiperidine.
Chemical Property Profile of 1'-(4-Nitrobenzyl)-1,4'-bipiperidine oxalate
Property Insights of 1'-(4-Nitrobenzyl)-1,4'-bipiperidine oxalate
The XLogP value of 3.0 indicates that 1'-(4-Nitrobenzyl)-1,4'-bipiperidine oxalate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.3 Ų, 1'-(4-Nitrobenzyl)-1,4'-bipiperidine oxalate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1'-(4-Nitrobenzyl)-1,4'-bipiperidine oxalate 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'-(4-Nitrobenzyl)-1,4'-bipiperidine oxalate?
The CAS number of 1'-(4-Nitrobenzyl)-1,4'-bipiperidine oxalate is 337489-26-6.
What is the molecular formula of 1'-(4-Nitrobenzyl)-1,4'-bipiperidine oxalate?
The molecular formula of 1'-(4-Nitrobenzyl)-1,4'-bipiperidine oxalate is C17H25N3O2.
What is the molecular weight of 1'-(4-Nitrobenzyl)-1,4'-bipiperidine oxalate?
The molecular weight of 1'-(4-Nitrobenzyl)-1,4'-bipiperidine oxalate is 303.19 g/mol.
Where can I buy 1'-(4-Nitrobenzyl)-1,4'-bipiperidine oxalate?
You can request a quote for 1'-(4-Nitrobenzyl)-1,4'-bipiperidine oxalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1'-(4-Nitrobenzyl)-1,4'-bipiperidine oxalate?
Yes, KEHONG BIO provides custom synthesis services for 1'-(4-Nitrobenzyl)-1,4'-bipiperidine oxalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.