Pyridinium, 4,4'-(p-phenylenebis(acryloylimino-p-phenyleneimino))bis(1-methyl-, di-p-toluenesulfonate
TL;DR: Pyridinium, 4,4'-(p-phenylenebis(acryloylimino-p-phenyleneimino))bis(1-methyl-, di-p-toluenesulfonate (CAS 20719-25-9) is a chemical compound with molecular formula C50H48N6O8S2 and molecular weight 924.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(4-methylbenzenesulfonate);(E)-3-[4-[(E)-3-[4-[(1-methylpyridin-1-ium-3-yl)amino]anilino]-3-oxoprop-1-enyl]phenyl]-N-[4-[(1-methylpyridin-1-ium-4-yl)amino]phenyl]prop-2-enamide
Also Known As: Pyridinium, 4,4'-(p-phenylenebis(acryloylimino-p-phenyleneimino))bis(1-methyl-, di-p-toluenesulfonate, 1-Methyl-3-{4-[(2E)-3-{4-[(1E)-3-{4-[(1-methylpyridin-1-ium-4-yl)amino]anilino}-3-oxoprop-1-en-1-yl]phenyl}prop-2-enamido]anilino}pyridin-1-ium bis(4-methylbenzene-1-sulfonate), 4-methylbenzenesulfonate; (E)-3-[4-[(E)-3-[4-[(1-methylpyridin-1-ium-3-yl)amino]anilino]-3-oxoprop-1-enyl]phenyl]-N-[4-[(1-methylpyridin-1-ium-4-yl)amino]phenyl]prop-2-enamide, RefChem:377215
| Molecular Formula | C50H48N6O8S2 |
|---|---|
| Molecular Weight | 924.30 g/mol |
| LogP | 7.92484 |
| Topological Polar Surface Area | 204.42 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 12 |
| Exact Mass | 924.2975 |
| Heavy Atoms | 66 |
| Complexity | 2925.3428 |
Chemical Identifiers
| CAS Number | 20719-25-9 |
|---|---|
| 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)NC(=O)/C=C/C3=CC=C(C=C3)/C=C/C(=O)NC4=CC=C(C=C4)NC5=C[N+](=CC=C5)C |
Product Overview
Pyridinium, 4,4'-(p-phenylenebis(acryloylimino-p-phenyleneimino))bis(1-methyl-, di-p-toluenesulfonate (CAS 20719-25-9), with molecular formula C50H48N6O8S2 and molecular weight 924.30 g/mol. IUPAC: bis(4-methylbenzenesulfonate);(E)-3-[4-[(E)-3-[4-[(1-methylpyridin-1-ium-3-yl)amino]anilino]-3-oxoprop-1-enyl]phenyl]-N-[4-[(1-methylpyridin-1-ium-4-yl)amino]phenyl]prop-2-enamide.
Chemical Property Profile of Pyridinium, 4,4'-(p-phenylenebis(acryloylimino-p-phenyleneimino))bis(1-methyl-, di-p-toluenesulfonate
Property Insights of Pyridinium, 4,4'-(p-phenylenebis(acryloylimino-p-phenyleneimino))bis(1-methyl-, di-p-toluenesulfonate
The XLogP value of 7.92484 indicates that Pyridinium, 4,4'-(p-phenylenebis(acryloylimino-p-phenyleneimino))bis(1-methyl-, di-p-toluenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 204.42 Ų indicates high polarity, suggesting Pyridinium, 4,4'-(p-phenylenebis(acryloylimino-p-phenyleneimino))bis(1-methyl-, di-p-toluenesulfonate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Pyridinium, 4,4'-(p-phenylenebis(acryloylimino-p-phenyleneimino))bis(1-methyl-, di-p-toluenesulfonate has 4 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pyridinium, 4,4'-(p-phenylenebis(acryloylimino-p-phenyleneimino))bis(1-methyl-, di-p-toluenesulfonate?
The CAS number of Pyridinium, 4,4'-(p-phenylenebis(acryloylimino-p-phenyleneimino))bis(1-methyl-, di-p-toluenesulfonate is 20719-25-9.
What is the molecular formula of Pyridinium, 4,4'-(p-phenylenebis(acryloylimino-p-phenyleneimino))bis(1-methyl-, di-p-toluenesulfonate?
The molecular formula of Pyridinium, 4,4'-(p-phenylenebis(acryloylimino-p-phenyleneimino))bis(1-methyl-, di-p-toluenesulfonate is C50H48N6O8S2.
What is the molecular weight of Pyridinium, 4,4'-(p-phenylenebis(acryloylimino-p-phenyleneimino))bis(1-methyl-, di-p-toluenesulfonate?
The molecular weight of Pyridinium, 4,4'-(p-phenylenebis(acryloylimino-p-phenyleneimino))bis(1-methyl-, di-p-toluenesulfonate is 924.30 g/mol.
Where can I buy Pyridinium, 4,4'-(p-phenylenebis(acryloylimino-p-phenyleneimino))bis(1-methyl-, di-p-toluenesulfonate?
You can request a quote for Pyridinium, 4,4'-(p-phenylenebis(acryloylimino-p-phenyleneimino))bis(1-methyl-, 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 Pyridinium, 4,4'-(p-phenylenebis(acryloylimino-p-phenyleneimino))bis(1-methyl-, di-p-toluenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for Pyridinium, 4,4'-(p-phenylenebis(acryloylimino-p-phenyleneimino))bis(1-methyl-, di-p-toluenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.