Quinolinium, 6-amino-8-methoxy-1-methyl-4-(p-(p-((1-methylpyridinium-4-yl)amino)benzamido)anilino)-, di-p-toluenesulfonate
TL;DR: Quinolinium, 6-amino-8-methoxy-1-methyl-4-(p-(p-((1-methylpyridinium-4-yl)amino)benzamido)anilino)-, di-p-toluenesulfonate (CAS 68772-17-8) is a chemical compound with molecular formula C44H44N6O8S2 and molecular weight 848.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[(6-amino-8-methoxy-1-methylquinolin-1-ium-4-yl)amino]phenyl]-4-[(1-methylpyridin-1-ium-4-yl)amino]benzamide;bis(4-methylbenzenesulfonate)
Also Known As: Quinolinium, 6-amino-8-methoxy-1-methyl-4-(p-(p-((1-methylpyridinium-4-yl)amino)benzamido)anilino)-, di-p-toluenesulfonate, N-[4-[(6-AMINO-8-METHOXY-1-METHYL-(QUINOLIN-4-YL))AMINO]PHENYL]-4-[(1-METHYL(PYRIDIN-4-YL))AMINO]BENZAMIDE; 4-METHYLBENZENESULFONATE, N-[4-[(6-amino-8-methoxy-1-methylquinolin-1-ium-4-yl)amino]phenyl]-4-[(1-methylpyridin-1-ium-4-yl)amino]benzamide; 4-methylbenzenesulfonate, RefChem:378817
| Molecular Formula | C44H44N6O8S2 |
|---|---|
| Molecular Weight | 848.27 g/mol |
| LogP | 6.61734 |
| Topological Polar Surface Area | 210.57 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 9 |
| Exact Mass | 848.2662 |
| Heavy Atoms | 60 |
| Complexity | 2730.0642 |
Chemical Identifiers
| CAS Number | 68772-17-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1=CC=C(C=C1)NC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)NC4=C5C=C(C=C(C5=[N+](C=C4)C)OC)N |
Product Overview
Quinolinium, 6-amino-8-methoxy-1-methyl-4-(p-(p-((1-methylpyridinium-4-yl)amino)benzamido)anilino)-, di-p-toluenesulfonate (CAS 68772-17-8), with molecular formula C44H44N6O8S2 and molecular weight 848.27 g/mol. IUPAC: N-[4-[(6-amino-8-methoxy-1-methylquinolin-1-ium-4-yl)amino]phenyl]-4-[(1-methylpyridin-1-ium-4-yl)amino]benzamide;bis(4-methylbenzenesulfonate).
Chemical Property Profile of Quinolinium, 6-amino-8-methoxy-1-methyl-4-(p-(p-((1-methylpyridinium-4-yl)amino)benzamido)anilino)-, di-p-toluenesulfonate
Property Insights of Quinolinium, 6-amino-8-methoxy-1-methyl-4-(p-(p-((1-methylpyridinium-4-yl)amino)benzamido)anilino)-, di-p-toluenesulfonate
The XLogP value of 6.61734 indicates that Quinolinium, 6-amino-8-methoxy-1-methyl-4-(p-(p-((1-methylpyridinium-4-yl)amino)benzamido)anilino)-, di-p-toluenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 210.57 Ų indicates high polarity, suggesting Quinolinium, 6-amino-8-methoxy-1-methyl-4-(p-(p-((1-methylpyridinium-4-yl)amino)benzamido)anilino)-, di-p-toluenesulfonate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Quinolinium, 6-amino-8-methoxy-1-methyl-4-(p-(p-((1-methylpyridinium-4-yl)amino)benzamido)anilino)-, di-p-toluenesulfonate has 4 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Quinolinium, 6-amino-8-methoxy-1-methyl-4-(p-(p-((1-methylpyridinium-4-yl)amino)benzamido)anilino)-, di-p-toluenesulfonate?
The CAS number of Quinolinium, 6-amino-8-methoxy-1-methyl-4-(p-(p-((1-methylpyridinium-4-yl)amino)benzamido)anilino)-, di-p-toluenesulfonate is 68772-17-8.
What is the molecular formula of Quinolinium, 6-amino-8-methoxy-1-methyl-4-(p-(p-((1-methylpyridinium-4-yl)amino)benzamido)anilino)-, di-p-toluenesulfonate?
The molecular formula of Quinolinium, 6-amino-8-methoxy-1-methyl-4-(p-(p-((1-methylpyridinium-4-yl)amino)benzamido)anilino)-, di-p-toluenesulfonate is C44H44N6O8S2.
What is the molecular weight of Quinolinium, 6-amino-8-methoxy-1-methyl-4-(p-(p-((1-methylpyridinium-4-yl)amino)benzamido)anilino)-, di-p-toluenesulfonate?
The molecular weight of Quinolinium, 6-amino-8-methoxy-1-methyl-4-(p-(p-((1-methylpyridinium-4-yl)amino)benzamido)anilino)-, di-p-toluenesulfonate is 848.27 g/mol.
Where can I buy Quinolinium, 6-amino-8-methoxy-1-methyl-4-(p-(p-((1-methylpyridinium-4-yl)amino)benzamido)anilino)-, di-p-toluenesulfonate?
You can request a quote for Quinolinium, 6-amino-8-methoxy-1-methyl-4-(p-(p-((1-methylpyridinium-4-yl)amino)benzamido)anilino)-, di-p-toluenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Quinolinium, 6-amino-8-methoxy-1-methyl-4-(p-(p-((1-methylpyridinium-4-yl)amino)benzamido)anilino)-, di-p-toluenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for Quinolinium, 6-amino-8-methoxy-1-methyl-4-(p-(p-((1-methylpyridinium-4-yl)amino)benzamido)anilino)-, di-p-toluenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.