![Pyridinium, 3-bromo-1-[2-hydroxy-2-(4-methoxyphenyl)-1-[[(3-methylphenyl)amino]thioxomethyl]ethenyl]-, inner salt structure](/static/products/1092/1092970-14-3.webp)
Pyridinium, 3-bromo-1-[2-hydroxy-2-(4-methoxyphenyl)-1-[[(3-methylphenyl)amino]thioxomethyl]ethenyl]-, inner salt
TL;DR: Pyridinium, 3-bromo-1-[2-hydroxy-2-(4-methoxyphenyl)-1-[[(3-methylphenyl)amino]thioxomethyl]ethenyl]-, inner salt (CAS 1092970-14-3) is a chemical compound with molecular formula C22H19BrN2O2S and molecular weight 454.03506 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(3-bromopyridin-1-ium-1-yl)-1-(4-methoxyphenyl)-3-(3-methylanilino)-3-sulfanylideneprop-1-en-1-olate
Also Known As: Pyridinium, 3-bromo-1-[2-hydroxy-2-(4-methoxyphenyl)-1-[[(3-methylphenyl)amino]thioxomethyl]ethenyl]-, inner salt, 2-(5-bromopyridin-1-yl)-1-(4-methoxyphenyl)-2-[(3-methylphenyl)thiocarbamoyl]ethenolate, 2-(3-bromopyridin-1-ium-1-yl)-1-(4-methoxyphenyl)-3-(3-methylanilino)-3-sulfanylideneprop-1-en-1-olate
Technical Specifications
| Molecular Formula | C22H19BrN2O2S |
| Molecular Weight | 454.03506 g/mol |
| XLogP | 6.4 |
| Topological Polar Surface Area (TPSA) | 80.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 454.03506 Da |
| Heavy Atoms | 28 |
| Complexity | 563.0 |
| SMILES | CC1=CC(=CC=C1)NC(=S)C(=C(C2=CC=C(C=C2)OC)[O-])[N+]3=CC=CC(=C3)Br |
| InChIKey | WMRQZRCDMNMLOR-UHFFFAOYSA-N |
Chemical Property Profile of Pyridinium, 3-bromo-1-[2-hydroxy-2-(4-methoxyphenyl)-1-[[(3-methylphenyl)amino]thioxomethyl]ethenyl]-, inner salt
Property Insights of Pyridinium, 3-bromo-1-[2-hydroxy-2-(4-methoxyphenyl)-1-[[(3-methylphenyl)amino]thioxomethyl]ethenyl]-, inner salt
The XLogP value of 6.4 indicates that Pyridinium, 3-bromo-1-[2-hydroxy-2-(4-methoxyphenyl)-1-[[(3-methylphenyl)amino]thioxomethyl]ethenyl]-, inner salt is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Pyridinium, 3-bromo-1-[2-hydroxy-2-(4-methoxyphenyl)-1-[[(3-methylphenyl)amino]thioxomethyl]ethenyl]-, inner salt. Following Lipinski's Rule of Five, Pyridinium, 3-bromo-1-[2-hydroxy-2-(4-methoxyphenyl)-1-[[(3-methylphenyl)amino]thioxomethyl]ethenyl]-, inner salt has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Pyridinium, 3-bromo-1-[2-hydroxy-2-(4-methoxyphenyl)-1-[[(3-methylphenyl)amino]thioxomethyl]ethenyl]-, inner salt?
The CAS number of Pyridinium, 3-bromo-1-[2-hydroxy-2-(4-methoxyphenyl)-1-[[(3-methylphenyl)amino]thioxomethyl]ethenyl]-, inner salt is 1092970-14-3.
What is the molecular formula of Pyridinium, 3-bromo-1-[2-hydroxy-2-(4-methoxyphenyl)-1-[[(3-methylphenyl)amino]thioxomethyl]ethenyl]-, inner salt?
The molecular formula of Pyridinium, 3-bromo-1-[2-hydroxy-2-(4-methoxyphenyl)-1-[[(3-methylphenyl)amino]thioxomethyl]ethenyl]-, inner salt is C22H19BrN2O2S.
What is the molecular weight of Pyridinium, 3-bromo-1-[2-hydroxy-2-(4-methoxyphenyl)-1-[[(3-methylphenyl)amino]thioxomethyl]ethenyl]-, inner salt?
The molecular weight of Pyridinium, 3-bromo-1-[2-hydroxy-2-(4-methoxyphenyl)-1-[[(3-methylphenyl)amino]thioxomethyl]ethenyl]-, inner salt is 454.03506 g/mol.
Where can I buy Pyridinium, 3-bromo-1-[2-hydroxy-2-(4-methoxyphenyl)-1-[[(3-methylphenyl)amino]thioxomethyl]ethenyl]-, inner salt?
You can request a quote for Pyridinium, 3-bromo-1-[2-hydroxy-2-(4-methoxyphenyl)-1-[[(3-methylphenyl)amino]thioxomethyl]ethenyl]-, inner salt directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Pyridinium, 3-bromo-1-[2-hydroxy-2-(4-methoxyphenyl)-1-[[(3-methylphenyl)amino]thioxomethyl]ethenyl]-, inner salt?
Yes, CoreyChem provides custom synthesis services for Pyridinium, 3-bromo-1-[2-hydroxy-2-(4-methoxyphenyl)-1-[[(3-methylphenyl)amino]thioxomethyl]ethenyl]-, inner salt and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.