Piperidinium, 1-(2-(N-benzylanilino)ethyl)-1-methyl-, bromide
TL;DR: Piperidinium, 1-(2-(N-benzylanilino)ethyl)-1-methyl-, bromide (CAS 101982-86-9) is a chemical compound with molecular formula C21H29BrN2 and molecular weight 388.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-N-[2-(1-methylpiperidin-1-ium-1-yl)ethyl]aniline bromide
Also Known As: 1-(2-(N-Benzylanilino)ethyl)-1-methyl-piperidinium bromide, N-Metil-N-(beta-benzilfenilaminoetil)piperidinio bromuro, Piperidinium, 1-(2-(N-benzylanilino)ethyl)-1-methyl-, bromide, N-Metil-N-(beta-benzilfenilaminoetil)piperidinio bromuro [Italian], 1-(2-(n-benzylanilino)ethyl)-1-methylpiperidinium bromide
| Molecular Formula | C21H29BrN2 |
|---|---|
| Molecular Weight | 388.15 g/mol |
| LogP | 1.3277 |
| Topological Polar Surface Area | 3.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 388.1514 |
| Heavy Atoms | 24 |
| Complexity | 579.3024 |
Chemical Identifiers
| CAS Number | 101982-86-9 |
|---|---|
| SMILES | C[N+]1(CCCCC1)CCN(CC2=CC=CC=C2)C3=CC=CC=C3.[Br-] |
Product Overview
Piperidinium, 1-(2-(N-benzylanilino)ethyl)-1-methyl-, bromide (CAS 101982-86-9), with molecular formula C21H29BrN2 and molecular weight 388.15 g/mol. IUPAC: N-benzyl-N-[2-(1-methylpiperidin-1-ium-1-yl)ethyl]aniline bromide.
Chemical Property Profile of Piperidinium, 1-(2-(N-benzylanilino)ethyl)-1-methyl-, bromide
Property Insights of Piperidinium, 1-(2-(N-benzylanilino)ethyl)-1-methyl-, bromide
The XLogP value of 1.3277 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Piperidinium, 1-(2-(N-benzylanilino)ethyl)-1-methyl-, bromide. With a topological polar surface area (TPSA) of 3.24 Ų, Piperidinium, 1-(2-(N-benzylanilino)ethyl)-1-methyl-, bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Piperidinium, 1-(2-(N-benzylanilino)ethyl)-1-methyl-, bromide has 0 hydrogen bond donor(s) and 1 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 Piperidinium, 1-(2-(N-benzylanilino)ethyl)-1-methyl-, bromide?
The CAS number of Piperidinium, 1-(2-(N-benzylanilino)ethyl)-1-methyl-, bromide is 101982-86-9.
What is the molecular formula of Piperidinium, 1-(2-(N-benzylanilino)ethyl)-1-methyl-, bromide?
The molecular formula of Piperidinium, 1-(2-(N-benzylanilino)ethyl)-1-methyl-, bromide is C21H29BrN2.
What is the molecular weight of Piperidinium, 1-(2-(N-benzylanilino)ethyl)-1-methyl-, bromide?
The molecular weight of Piperidinium, 1-(2-(N-benzylanilino)ethyl)-1-methyl-, bromide is 388.15 g/mol.
Where can I buy Piperidinium, 1-(2-(N-benzylanilino)ethyl)-1-methyl-, bromide?
You can request a quote for Piperidinium, 1-(2-(N-benzylanilino)ethyl)-1-methyl-, bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Piperidinium, 1-(2-(N-benzylanilino)ethyl)-1-methyl-, bromide?
Yes, KEHONG BIO provides custom synthesis services for Piperidinium, 1-(2-(N-benzylanilino)ethyl)-1-methyl-, bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.