Pyridinium, 3-(aminocarbonyl)-1-hexyl-,bromide (1:1)
TL;DR: Pyridinium, 3-(aminocarbonyl)-1-hexyl-,bromide (1:1) (CAS 28356-43-6) is a chemical compound with molecular formula C12H19N2O+ and molecular weight 207.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-hexylpyridin-1-ium-3-carboxamide
Also Known As: 3-carbamoyl-1-hexylpyridinium, 1-Hexyl-3-carbamoylpyridinium, 1-hexylpyridin-1-ium-3-carboxamide, Pyridinium, 3-(aminocarbonyl)-1-hexyl-,bromide (1:1), Pyridinium,3-(aminocarbonyl)-1-hexyl-,bromide(1:1)
| Molecular Formula | C12H19N2O+ |
|---|---|
| Molecular Weight | 207.15 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 47.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 207.14973 |
| Heavy Atoms | 15 |
| Complexity | 194.0 |
Chemical Identifiers
| CAS Number | 28356-43-6 |
|---|---|
| SMILES | CCCCCC[N+]1=CC=CC(=C1)C(=O)N |
| InChIKey | PVMWZBOSCFWICX-UHFFFAOYSA-O |
Product Overview
Pyridinium, 3-(aminocarbonyl)-1-hexyl-,bromide (1:1) (CAS 28356-43-6), with molecular formula C12H19N2O+ and molecular weight 207.15 g/mol. IUPAC: 1-hexylpyridin-1-ium-3-carboxamide.
Chemical Property Profile of Pyridinium, 3-(aminocarbonyl)-1-hexyl-,bromide (1:1)
Property Insights of Pyridinium, 3-(aminocarbonyl)-1-hexyl-,bromide (1:1)
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyridinium, 3-(aminocarbonyl)-1-hexyl-,bromide (1:1). With a topological polar surface area (TPSA) of 47.0 Ų, Pyridinium, 3-(aminocarbonyl)-1-hexyl-,bromide (1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyridinium, 3-(aminocarbonyl)-1-hexyl-,bromide (1:1) has 1 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 Pyridinium, 3-(aminocarbonyl)-1-hexyl-,bromide (1:1)?
The CAS number of Pyridinium, 3-(aminocarbonyl)-1-hexyl-,bromide (1:1) is 28356-43-6.
What is the molecular formula of Pyridinium, 3-(aminocarbonyl)-1-hexyl-,bromide (1:1)?
The molecular formula of Pyridinium, 3-(aminocarbonyl)-1-hexyl-,bromide (1:1) is C12H19N2O+.
What is the molecular weight of Pyridinium, 3-(aminocarbonyl)-1-hexyl-,bromide (1:1)?
The molecular weight of Pyridinium, 3-(aminocarbonyl)-1-hexyl-,bromide (1:1) is 207.15 g/mol.
Where can I buy Pyridinium, 3-(aminocarbonyl)-1-hexyl-,bromide (1:1)?
You can request a quote for Pyridinium, 3-(aminocarbonyl)-1-hexyl-,bromide (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyridinium, 3-(aminocarbonyl)-1-hexyl-,bromide (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Pyridinium, 3-(aminocarbonyl)-1-hexyl-,bromide (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.