2-Methyl-4-quinolinyl 2,5-dimethoxybenzenesulfonate
TL;DR: 2-Methyl-4-quinolinyl 2,5-dimethoxybenzenesulfonate (CAS 681853-46-3) is a chemical compound with molecular formula C18H17NO5S and molecular weight 359.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-methylquinolin-4-yl) 2,5-dimethoxybenzenesulfonate
Also Known As: 2-Methyl-4-quinolinyl 2,5-dimethoxybenzenesulfonate, 2-methyl-4-quinolyl 2,5-dimethoxybenzenesulfonate, 2-methylquinolin-4-yl 2,5-dimethoxybenzenesulfonate, A2942/0123889, (2-methylquinolin-4-yl) 2,5-dimethoxybenzenesulfonate
| Molecular Formula | C18H17NO5S |
|---|---|
| Molecular Weight | 359.08 g/mol |
| LogP | 3.32812 |
| Topological Polar Surface Area | 74.72 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 359.08273 |
| Heavy Atoms | 25 |
| Complexity | 1030.8159 |
Chemical Identifiers
| CAS Number | 681853-46-3 |
|---|---|
| SMILES | CC1=NC2=CC=CC=C2C(=C1)OS(=O)(=O)C3=C(C=CC(=C3)OC)OC |
Product Overview
2-Methyl-4-quinolinyl 2,5-dimethoxybenzenesulfonate (CAS 681853-46-3), with molecular formula C18H17NO5S and molecular weight 359.08 g/mol. IUPAC: (2-methylquinolin-4-yl) 2,5-dimethoxybenzenesulfonate.
Chemical Property Profile of 2-Methyl-4-quinolinyl 2,5-dimethoxybenzenesulfonate
Property Insights of 2-Methyl-4-quinolinyl 2,5-dimethoxybenzenesulfonate
The XLogP value of 3.32812 indicates that 2-Methyl-4-quinolinyl 2,5-dimethoxybenzenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.72 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methyl-4-quinolinyl 2,5-dimethoxybenzenesulfonate. Following Lipinski's Rule of Five, 2-Methyl-4-quinolinyl 2,5-dimethoxybenzenesulfonate has 0 hydrogen bond donor(s) and 6 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-Methyl-4-quinolinyl 2,5-dimethoxybenzenesulfonate?
The CAS number of 2-Methyl-4-quinolinyl 2,5-dimethoxybenzenesulfonate is 681853-46-3.
What is the molecular formula of 2-Methyl-4-quinolinyl 2,5-dimethoxybenzenesulfonate?
The molecular formula of 2-Methyl-4-quinolinyl 2,5-dimethoxybenzenesulfonate is C18H17NO5S.
What is the molecular weight of 2-Methyl-4-quinolinyl 2,5-dimethoxybenzenesulfonate?
The molecular weight of 2-Methyl-4-quinolinyl 2,5-dimethoxybenzenesulfonate is 359.08 g/mol.
Where can I buy 2-Methyl-4-quinolinyl 2,5-dimethoxybenzenesulfonate?
You can request a quote for 2-Methyl-4-quinolinyl 2,5-dimethoxybenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-4-quinolinyl 2,5-dimethoxybenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-4-quinolinyl 2,5-dimethoxybenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.