Quinolinium, 4-(2-(acetylphenylamino)ethenyl)-1-butyl-, iodide (1:1)
TL;DR: Quinolinium, 4-(2-(acetylphenylamino)ethenyl)-1-butyl-, iodide (1:1) (CAS 71173-76-7) is a chemical compound with molecular formula C23H25IN2O and molecular weight 472.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(1-butylquinolin-1-ium-4-yl)ethenyl]-N-phenylacetamide iodide
Also Known As: 4-(2-Acetanilinovinyl)-1-butylquinolinium iodide, Quinolinium, 4-(2-(acetylphenylamino)ethenyl)-1-butyl-, iodide, Quinolinium, 4-(2-(acetylphenylamino)ethenyl)-1-butyl-, iodide (1:1), Quinolinium, 4-[2-(acetylphenylamino)ethenyl]-1-butyl-, iodide (1:1), 1-Butyl-4-[2-(N-phenylacetamido)ethen-1-yl]quinolin-1-ium iodide
| Molecular Formula | C23H25IN2O |
|---|---|
| Molecular Weight | 472.10 g/mol |
| LogP | 1.96 |
| Topological Polar Surface Area | 24.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 472.10117 |
| Heavy Atoms | 27 |
| Complexity | 469.0 |
Chemical Identifiers
| CAS Number | 71173-76-7 |
|---|---|
| SMILES | CCCC[N+]1=CC=C(C2=CC=CC=C21)C=CN(C3=CC=CC=C3)C(=O)C.[I-] |
| InChIKey | XSGWKIBPNTZADF-UHFFFAOYSA-M |
Product Overview
Quinolinium, 4-(2-(acetylphenylamino)ethenyl)-1-butyl-, iodide (1:1) (CAS 71173-76-7), with molecular formula C23H25IN2O and molecular weight 472.10 g/mol. IUPAC: N-[2-(1-butylquinolin-1-ium-4-yl)ethenyl]-N-phenylacetamide iodide.
Chemical Property Profile of Quinolinium, 4-(2-(acetylphenylamino)ethenyl)-1-butyl-, iodide (1:1)
Property Insights of Quinolinium, 4-(2-(acetylphenylamino)ethenyl)-1-butyl-, iodide (1:1)
The XLogP value of 1.96 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Quinolinium, 4-(2-(acetylphenylamino)ethenyl)-1-butyl-, iodide (1:1). With a topological polar surface area (TPSA) of 24.2 Ų, Quinolinium, 4-(2-(acetylphenylamino)ethenyl)-1-butyl-, iodide (1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Quinolinium, 4-(2-(acetylphenylamino)ethenyl)-1-butyl-, iodide (1:1) has 0 hydrogen bond donor(s) and 2 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 Quinolinium, 4-(2-(acetylphenylamino)ethenyl)-1-butyl-, iodide (1:1)?
The CAS number of Quinolinium, 4-(2-(acetylphenylamino)ethenyl)-1-butyl-, iodide (1:1) is 71173-76-7.
What is the molecular formula of Quinolinium, 4-(2-(acetylphenylamino)ethenyl)-1-butyl-, iodide (1:1)?
The molecular formula of Quinolinium, 4-(2-(acetylphenylamino)ethenyl)-1-butyl-, iodide (1:1) is C23H25IN2O.
What is the molecular weight of Quinolinium, 4-(2-(acetylphenylamino)ethenyl)-1-butyl-, iodide (1:1)?
The molecular weight of Quinolinium, 4-(2-(acetylphenylamino)ethenyl)-1-butyl-, iodide (1:1) is 472.10 g/mol.
Where can I buy Quinolinium, 4-(2-(acetylphenylamino)ethenyl)-1-butyl-, iodide (1:1)?
You can request a quote for Quinolinium, 4-(2-(acetylphenylamino)ethenyl)-1-butyl-, iodide (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Quinolinium, 4-(2-(acetylphenylamino)ethenyl)-1-butyl-, iodide (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Quinolinium, 4-(2-(acetylphenylamino)ethenyl)-1-butyl-, iodide (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.