Piperidinium, 1-heptyl-1-(2-hydroxyethyl)-, bromide, o-(heptyloxy)carbanilate
TL;DR: Piperidinium, 1-heptyl-1-(2-hydroxyethyl)-, bromide, o-(heptyloxy)carbanilate (CAS 69336-58-9) is a chemical compound with molecular formula C28H49BrN2O3 and molecular weight 540.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-heptylpiperidin-1-ium-1-yl)ethyl N-(2-heptoxyphenyl)carbamate bromide
Also Known As: 1-Heptyl-1-(2-hydroxyethyl)piperidinium bromide o-(heptyloxy)carbanilate, Piperidinium, 1-heptyl-1-(2-((((2-(heptyloxy)phenyl)amino)carbonyl)oxy)ethyl)-, bromide, Piperidinium, 1-heptyl-1-(2-hydroxyethyl)-, bromide, o-(heptyloxy)carbanilate, 2-(1-heptylpiperidin-1-ium-1-yl)ethyl N-(2-heptoxyphenyl)carbamate bromide, RefChem:373481
| Molecular Formula | C28H49BrN2O3 |
|---|---|
| Molecular Weight | 540.29 g/mol |
| LogP | 4.5594 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 17 |
| Exact Mass | 540.29266 |
| Heavy Atoms | 34 |
| Complexity | 650.29333 |
Chemical Identifiers
| CAS Number | 69336-58-9 |
|---|---|
| SMILES | CCCCCCC[N+]1(CCCCC1)CCOC(=O)NC2=CC=CC=C2OCCCCCCC.[Br-] |
Product Overview
Piperidinium, 1-heptyl-1-(2-hydroxyethyl)-, bromide, o-(heptyloxy)carbanilate (CAS 69336-58-9), with molecular formula C28H49BrN2O3 and molecular weight 540.29 g/mol. IUPAC: 2-(1-heptylpiperidin-1-ium-1-yl)ethyl N-(2-heptoxyphenyl)carbamate bromide.
Chemical Property Profile of Piperidinium, 1-heptyl-1-(2-hydroxyethyl)-, bromide, o-(heptyloxy)carbanilate
Property Insights of Piperidinium, 1-heptyl-1-(2-hydroxyethyl)-, bromide, o-(heptyloxy)carbanilate
The XLogP value of 4.5594 indicates that Piperidinium, 1-heptyl-1-(2-hydroxyethyl)-, bromide, o-(heptyloxy)carbanilate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.56 Ų, Piperidinium, 1-heptyl-1-(2-hydroxyethyl)-, bromide, o-(heptyloxy)carbanilate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Piperidinium, 1-heptyl-1-(2-hydroxyethyl)-, bromide, o-(heptyloxy)carbanilate has 1 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 Piperidinium, 1-heptyl-1-(2-hydroxyethyl)-, bromide, o-(heptyloxy)carbanilate?
The CAS number of Piperidinium, 1-heptyl-1-(2-hydroxyethyl)-, bromide, o-(heptyloxy)carbanilate is 69336-58-9.
What is the molecular formula of Piperidinium, 1-heptyl-1-(2-hydroxyethyl)-, bromide, o-(heptyloxy)carbanilate?
The molecular formula of Piperidinium, 1-heptyl-1-(2-hydroxyethyl)-, bromide, o-(heptyloxy)carbanilate is C28H49BrN2O3.
What is the molecular weight of Piperidinium, 1-heptyl-1-(2-hydroxyethyl)-, bromide, o-(heptyloxy)carbanilate?
The molecular weight of Piperidinium, 1-heptyl-1-(2-hydroxyethyl)-, bromide, o-(heptyloxy)carbanilate is 540.29 g/mol.
Where can I buy Piperidinium, 1-heptyl-1-(2-hydroxyethyl)-, bromide, o-(heptyloxy)carbanilate?
You can request a quote for Piperidinium, 1-heptyl-1-(2-hydroxyethyl)-, bromide, o-(heptyloxy)carbanilate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Piperidinium, 1-heptyl-1-(2-hydroxyethyl)-, bromide, o-(heptyloxy)carbanilate?
Yes, KEHONG BIO provides custom synthesis services for Piperidinium, 1-heptyl-1-(2-hydroxyethyl)-, bromide, o-(heptyloxy)carbanilate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.