5-((2-(2-(4-(Hexadecyloxy)phenyl)-1-methyl-6-sulfoquinolin-4(1H)-ylidene)hydrazinyl)sulfonyl)-2-hydroxybenzoic acid
TL;DR: 5-((2-(2-(4-(Hexadecyloxy)phenyl)-1-methyl-6-sulfoquinolin-4(1H)-ylidene)hydrazinyl)sulfonyl)-2-hydroxybenzoic acid (CAS 196601-56-6) is a chemical compound with molecular formula C39H51N3O9S2 and molecular weight 769.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[[(Z)-[2-(4-hexadecoxyphenyl)-1-methyl-6-sulfoquinolin-4-ylidene]amino]sulfamoyl]-2-hydroxybenzoic acid
Also Known As: 5-((2-(2-(4-(Hexadecyloxy)phenyl)-1-methyl-6-sulfoquinolin-4(1H)-ylidene)hydrazinyl)sulfonyl)-2-hydroxybenzoic acid, CARBOXY-HYDROXYBENZENESULFONIC HEXADECYLOXYPHENYL-METHYL-SULFOQUINOLYLIDENHYDRAZ
| Molecular Formula | C39H51N3O9S2 |
|---|---|
| Molecular Weight | 769.31 g/mol |
| LogP | 8.1501 |
| Topological Polar Surface Area | 184.59 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 22 |
| Exact Mass | 769.3067 |
| Heavy Atoms | 53 |
| Complexity | 2130.066 |
Chemical Identifiers
| CAS Number | 196601-56-6 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCOC1=CC=C(C=C1)C2=C/C(=N/NS(=O)(=O)C3=CC(=C(C=C3)O)C(=O)O)/C4=C(N2C)C=CC(=C4)S(=O)(=O)O |
Product Overview
5-((2-(2-(4-(Hexadecyloxy)phenyl)-1-methyl-6-sulfoquinolin-4(1H)-ylidene)hydrazinyl)sulfonyl)-2-hydroxybenzoic acid (CAS 196601-56-6), with molecular formula C39H51N3O9S2 and molecular weight 769.31 g/mol. IUPAC: 5-[[(Z)-[2-(4-hexadecoxyphenyl)-1-methyl-6-sulfoquinolin-4-ylidene]amino]sulfamoyl]-2-hydroxybenzoic acid.
Chemical Property Profile of 5-((2-(2-(4-(Hexadecyloxy)phenyl)-1-methyl-6-sulfoquinolin-4(1H)-ylidene)hydrazinyl)sulfonyl)-2-hydroxybenzoic acid
Property Insights of 5-((2-(2-(4-(Hexadecyloxy)phenyl)-1-methyl-6-sulfoquinolin-4(1H)-ylidene)hydrazinyl)sulfonyl)-2-hydroxybenzoic acid
The XLogP value of 8.1501 indicates that 5-((2-(2-(4-(Hexadecyloxy)phenyl)-1-methyl-6-sulfoquinolin-4(1H)-ylidene)hydrazinyl)sulfonyl)-2-hydroxybenzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 184.59 Ų indicates high polarity, suggesting 5-((2-(2-(4-(Hexadecyloxy)phenyl)-1-methyl-6-sulfoquinolin-4(1H)-ylidene)hydrazinyl)sulfonyl)-2-hydroxybenzoic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5-((2-(2-(4-(Hexadecyloxy)phenyl)-1-methyl-6-sulfoquinolin-4(1H)-ylidene)hydrazinyl)sulfonyl)-2-hydroxybenzoic acid has 4 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-((2-(2-(4-(Hexadecyloxy)phenyl)-1-methyl-6-sulfoquinolin-4(1H)-ylidene)hydrazinyl)sulfonyl)-2-hydroxybenzoic acid?
The CAS number of 5-((2-(2-(4-(Hexadecyloxy)phenyl)-1-methyl-6-sulfoquinolin-4(1H)-ylidene)hydrazinyl)sulfonyl)-2-hydroxybenzoic acid is 196601-56-6.
What is the molecular formula of 5-((2-(2-(4-(Hexadecyloxy)phenyl)-1-methyl-6-sulfoquinolin-4(1H)-ylidene)hydrazinyl)sulfonyl)-2-hydroxybenzoic acid?
The molecular formula of 5-((2-(2-(4-(Hexadecyloxy)phenyl)-1-methyl-6-sulfoquinolin-4(1H)-ylidene)hydrazinyl)sulfonyl)-2-hydroxybenzoic acid is C39H51N3O9S2.
What is the molecular weight of 5-((2-(2-(4-(Hexadecyloxy)phenyl)-1-methyl-6-sulfoquinolin-4(1H)-ylidene)hydrazinyl)sulfonyl)-2-hydroxybenzoic acid?
The molecular weight of 5-((2-(2-(4-(Hexadecyloxy)phenyl)-1-methyl-6-sulfoquinolin-4(1H)-ylidene)hydrazinyl)sulfonyl)-2-hydroxybenzoic acid is 769.31 g/mol.
Where can I buy 5-((2-(2-(4-(Hexadecyloxy)phenyl)-1-methyl-6-sulfoquinolin-4(1H)-ylidene)hydrazinyl)sulfonyl)-2-hydroxybenzoic acid?
You can request a quote for 5-((2-(2-(4-(Hexadecyloxy)phenyl)-1-methyl-6-sulfoquinolin-4(1H)-ylidene)hydrazinyl)sulfonyl)-2-hydroxybenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-((2-(2-(4-(Hexadecyloxy)phenyl)-1-methyl-6-sulfoquinolin-4(1H)-ylidene)hydrazinyl)sulfonyl)-2-hydroxybenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-((2-(2-(4-(Hexadecyloxy)phenyl)-1-methyl-6-sulfoquinolin-4(1H)-ylidene)hydrazinyl)sulfonyl)-2-hydroxybenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.