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2-[(1-Ethyl-2 methyl]-1- quinolinium,innersalt
TL;DR: 2-[(1-Ethyl-2 methyl]-1- quinolinium,innersalt (CAS 53440-14-5) is a chemical compound with molecular formula C24H24N2O3S and molecular weight 420.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-[(Z)-(1-ethylquinolin-2-ylidene)methyl]quinolin-1-ium-1-yl]propane-1-sulfonate
Also Known As: 2-[(1-Ethyl-2 methyl]-1- quinolinium,innersalt
| Molecular Formula | C24H24N2O3S |
|---|---|
| Molecular Weight | 420.15 g/mol |
| LogP | 3.9568 |
| Topological Polar Surface Area | 64.32 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 420.15076 |
| Heavy Atoms | 30 |
| Complexity | 1246.2957 |
Chemical Identifiers
| CAS Number | 53440-14-5 |
|---|---|
| SMILES | CCN1/C(=C\C2=[N+](C3=CC=CC=C3C=C2)CCCS(=O)(=O)[O-])/C=CC4=CC=CC=C41 |
Product Overview
2-[(1-Ethyl-2 methyl]-1- quinolinium,innersalt (CAS 53440-14-5), with molecular formula C24H24N2O3S and molecular weight 420.15 g/mol. IUPAC: 3-[2-[(Z)-(1-ethylquinolin-2-ylidene)methyl]quinolin-1-ium-1-yl]propane-1-sulfonate.
Chemical Property Profile of 2-[(1-Ethyl-2 methyl]-1- quinolinium,innersalt
Property Insights of 2-[(1-Ethyl-2 methyl]-1- quinolinium,innersalt
The XLogP value of 3.9568 indicates that 2-[(1-Ethyl-2 methyl]-1- quinolinium,innersalt is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.32 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(1-Ethyl-2 methyl]-1- quinolinium,innersalt. Following Lipinski's Rule of Five, 2-[(1-Ethyl-2 methyl]-1- quinolinium,innersalt has 0 hydrogen bond donor(s) and 4 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 2-[(1-Ethyl-2 methyl]-1- quinolinium,innersalt?
The CAS number of 2-[(1-Ethyl-2 methyl]-1- quinolinium,innersalt is 53440-14-5.
What is the molecular formula of 2-[(1-Ethyl-2 methyl]-1- quinolinium,innersalt?
The molecular formula of 2-[(1-Ethyl-2 methyl]-1- quinolinium,innersalt is C24H24N2O3S.
What is the molecular weight of 2-[(1-Ethyl-2 methyl]-1- quinolinium,innersalt?
The molecular weight of 2-[(1-Ethyl-2 methyl]-1- quinolinium,innersalt is 420.15 g/mol.
Where can I buy 2-[(1-Ethyl-2 methyl]-1- quinolinium,innersalt?
You can request a quote for 2-[(1-Ethyl-2 methyl]-1- quinolinium,innersalt directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(1-Ethyl-2 methyl]-1- quinolinium,innersalt?
Yes, KEHONG BIO provides custom synthesis services for 2-[(1-Ethyl-2 methyl]-1- quinolinium,innersalt and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.