quinolinium, 4-methyl-1-(3-sulfopropyl)-, inner salt
TL;DR: quinolinium, 4-methyl-1-(3-sulfopropyl)-, inner salt (CAS 56405-66-4) is a chemical compound with molecular formula C13H15NO3S and molecular weight 265.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-methylquinolin-1-ium-1-yl)propane-1-sulfonate
Also Known As: 3-(4-methylquinolyl)propanesulfonic acid, BAS 00481285, Quinolinium, 4-methyl-1-(3-sulfopropyl)-, inner salt, 1-(3-Sulfonatopropyl)-4-methylquinolinium, 4-METHYL-1-(3-SULFONATOPROPYL)QUINOLIN-1-IUM
| Molecular Formula | C13H15NO3S |
|---|---|
| Molecular Weight | 265.08 g/mol |
| LogP | 1.37102 |
| Topological Polar Surface Area | 61.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 265.07727 |
| Heavy Atoms | 18 |
| Complexity | 664.9907 |
Chemical Identifiers
| CAS Number | 56405-66-4 |
|---|---|
| SMILES | CC1=CC=[N+](C2=CC=CC=C12)CCCS(=O)(=O)[O-] |
Product Overview
quinolinium, 4-methyl-1-(3-sulfopropyl)-, inner salt (CAS 56405-66-4), with molecular formula C13H15NO3S and molecular weight 265.08 g/mol. IUPAC: 3-(4-methylquinolin-1-ium-1-yl)propane-1-sulfonate.
Chemical Property Profile of quinolinium, 4-methyl-1-(3-sulfopropyl)-, inner salt
Property Insights of quinolinium, 4-methyl-1-(3-sulfopropyl)-, inner salt
The XLogP value of 1.37102 suggests moderate lipophilicity, balancing water solubility and membrane permeability for quinolinium, 4-methyl-1-(3-sulfopropyl)-, inner salt. The TPSA of 61.08 Ų falls within the moderate polarity range, balancing permeability and solubility for quinolinium, 4-methyl-1-(3-sulfopropyl)-, inner salt. Following Lipinski's Rule of Five, quinolinium, 4-methyl-1-(3-sulfopropyl)-, inner salt has 0 hydrogen bond donor(s) and 3 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-methyl-1-(3-sulfopropyl)-, inner salt?
The CAS number of quinolinium, 4-methyl-1-(3-sulfopropyl)-, inner salt is 56405-66-4.
What is the molecular formula of quinolinium, 4-methyl-1-(3-sulfopropyl)-, inner salt?
The molecular formula of quinolinium, 4-methyl-1-(3-sulfopropyl)-, inner salt is C13H15NO3S.
What is the molecular weight of quinolinium, 4-methyl-1-(3-sulfopropyl)-, inner salt?
The molecular weight of quinolinium, 4-methyl-1-(3-sulfopropyl)-, inner salt is 265.08 g/mol.
Where can I buy quinolinium, 4-methyl-1-(3-sulfopropyl)-, inner salt?
You can request a quote for quinolinium, 4-methyl-1-(3-sulfopropyl)-, inner salt directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for quinolinium, 4-methyl-1-(3-sulfopropyl)-, inner salt?
Yes, KEHONG BIO provides custom synthesis services for quinolinium, 4-methyl-1-(3-sulfopropyl)-, inner salt and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.