Quinolinium, 1-butyl-6-(p-(1-butyl-6-quinoliniocarbamoyl)carbaniloyl)-, ditosylate
TL;DR: Quinolinium, 1-butyl-6-(p-(1-butyl-6-quinoliniocarbamoyl)carbaniloyl)-, ditosylate (CAS 19055-99-3) is a chemical compound with molecular formula C48H50N4O8S2 and molecular weight 874.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butyl-N-[4-[(1-butylquinolin-1-ium-6-yl)carbamoyl]phenyl]quinolin-1-ium-6-carboxamide;bis(4-methylbenzenesulfonate)
Also Known As: Quinolinium, 1-butyl-6-(p-(1-butyl-6-quinoliniocarbamoyl)carbaniloyl)-, ditosylate, 1-Butyl-6-(p-(1-butyl-6-quinoliniocarbamoyl)carbaniloyl)quinolinium ditosylate, 1-Butyl-6-({4-[(1-butylquinolin-1-ium-6-yl)carbamoyl]phenyl}carbamoyl)quinolin-1-ium bis(4-methylbenzene-1-sulfonate), 1-butyl-N-[4-[(1-butylquinolin-1-ium-6-yl)carbamoyl]phenyl]quinolin-1-ium-6-carboxamide; 4-methylbenzenesulfonate, Quinolinium, 1-butyl-6-[[[4-[[(1-butylquinolinium-6-yl)amino]carbonyl]phenyl]amino]carbonyl]-, salt with 4-methylbenzenesulfonic acid (1:2)
| Molecular Formula | C48H50N4O8S2 |
|---|---|
| Molecular Weight | 874.31 g/mol |
| LogP | 8.47104 |
| Topological Polar Surface Area | 197.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 874.307 |
| Heavy Atoms | 62 |
| Complexity | 1000.0 |
Chemical Identifiers
| CAS Number | 19055-99-3 |
|---|---|
| SMILES | CCCC[N+]1=CC=CC2=C1C=CC(=C2)C(=O)NC3=CC=C(C=C3)C(=O)NC4=CC5=C(C=C4)[N+](=CC=C5)CCCC.CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-] |
| InChIKey | NNSGDZSZBLNVBC-UHFFFAOYSA-N |
Product Overview
Quinolinium, 1-butyl-6-(p-(1-butyl-6-quinoliniocarbamoyl)carbaniloyl)-, ditosylate (CAS 19055-99-3), with molecular formula C48H50N4O8S2 and molecular weight 874.31 g/mol. IUPAC: 1-butyl-N-[4-[(1-butylquinolin-1-ium-6-yl)carbamoyl]phenyl]quinolin-1-ium-6-carboxamide;bis(4-methylbenzenesulfonate).
Chemical Property Profile of Quinolinium, 1-butyl-6-(p-(1-butyl-6-quinoliniocarbamoyl)carbaniloyl)-, ditosylate
Property Insights of Quinolinium, 1-butyl-6-(p-(1-butyl-6-quinoliniocarbamoyl)carbaniloyl)-, ditosylate
The XLogP value of 8.47104 indicates that Quinolinium, 1-butyl-6-(p-(1-butyl-6-quinoliniocarbamoyl)carbaniloyl)-, ditosylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 197.0 Ų indicates high polarity, suggesting Quinolinium, 1-butyl-6-(p-(1-butyl-6-quinoliniocarbamoyl)carbaniloyl)-, ditosylate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Quinolinium, 1-butyl-6-(p-(1-butyl-6-quinoliniocarbamoyl)carbaniloyl)-, ditosylate has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Quinolinium, 1-butyl-6-(p-(1-butyl-6-quinoliniocarbamoyl)carbaniloyl)-, ditosylate?
The CAS number of Quinolinium, 1-butyl-6-(p-(1-butyl-6-quinoliniocarbamoyl)carbaniloyl)-, ditosylate is 19055-99-3.
What is the molecular formula of Quinolinium, 1-butyl-6-(p-(1-butyl-6-quinoliniocarbamoyl)carbaniloyl)-, ditosylate?
The molecular formula of Quinolinium, 1-butyl-6-(p-(1-butyl-6-quinoliniocarbamoyl)carbaniloyl)-, ditosylate is C48H50N4O8S2.
What is the molecular weight of Quinolinium, 1-butyl-6-(p-(1-butyl-6-quinoliniocarbamoyl)carbaniloyl)-, ditosylate?
The molecular weight of Quinolinium, 1-butyl-6-(p-(1-butyl-6-quinoliniocarbamoyl)carbaniloyl)-, ditosylate is 874.31 g/mol.
Where can I buy Quinolinium, 1-butyl-6-(p-(1-butyl-6-quinoliniocarbamoyl)carbaniloyl)-, ditosylate?
You can request a quote for Quinolinium, 1-butyl-6-(p-(1-butyl-6-quinoliniocarbamoyl)carbaniloyl)-, ditosylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Quinolinium, 1-butyl-6-(p-(1-butyl-6-quinoliniocarbamoyl)carbaniloyl)-, ditosylate?
Yes, KEHONG BIO provides custom synthesis services for Quinolinium, 1-butyl-6-(p-(1-butyl-6-quinoliniocarbamoyl)carbaniloyl)-, ditosylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.