2-Methyl-8-quinolyl 4-chloro-2-methoxybenzenesulfonate
TL;DR: 2-Methyl-8-quinolyl 4-chloro-2-methoxybenzenesulfonate (CAS 446309-06-4) is a chemical compound with molecular formula C17H14ClNO4S and molecular weight 363.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-methylquinolin-8-yl) 4-chloro-2-methoxybenzenesulfonate
Also Known As: 2-methyl-8-quinolyl 4-chloro-2-methoxybenzenesulfonate, (2-methylquinolin-8-yl) 4-chloro-2-methoxybenzenesulfonate, 2-methylquinolin-8-yl 4-chloro-2-methoxybenzenesulfonate, AP-263/40778214, 2-methyl-8-quinolinyl 4-chloro-2-methoxybenzenesulfonate
| Molecular Formula | C17H14ClNO4S |
|---|---|
| Molecular Weight | 363.03 g/mol |
| LogP | 3.97292 |
| Topological Polar Surface Area | 65.49 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 363.0332 |
| Heavy Atoms | 24 |
| Complexity | 1018.2743 |
Chemical Identifiers
| CAS Number | 446309-06-4 |
|---|---|
| SMILES | CC1=NC2=C(C=CC=C2OS(=O)(=O)C3=C(C=C(C=C3)Cl)OC)C=C1 |
Product Overview
2-Methyl-8-quinolyl 4-chloro-2-methoxybenzenesulfonate (CAS 446309-06-4), with molecular formula C17H14ClNO4S and molecular weight 363.03 g/mol. IUPAC: (2-methylquinolin-8-yl) 4-chloro-2-methoxybenzenesulfonate.
Chemical Property Profile of 2-Methyl-8-quinolyl 4-chloro-2-methoxybenzenesulfonate
Property Insights of 2-Methyl-8-quinolyl 4-chloro-2-methoxybenzenesulfonate
The XLogP value of 3.97292 indicates that 2-Methyl-8-quinolyl 4-chloro-2-methoxybenzenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.49 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methyl-8-quinolyl 4-chloro-2-methoxybenzenesulfonate. Following Lipinski's Rule of Five, 2-Methyl-8-quinolyl 4-chloro-2-methoxybenzenesulfonate has 0 hydrogen bond donor(s) and 5 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-8-quinolyl 4-chloro-2-methoxybenzenesulfonate?
The CAS number of 2-Methyl-8-quinolyl 4-chloro-2-methoxybenzenesulfonate is 446309-06-4.
What is the molecular formula of 2-Methyl-8-quinolyl 4-chloro-2-methoxybenzenesulfonate?
The molecular formula of 2-Methyl-8-quinolyl 4-chloro-2-methoxybenzenesulfonate is C17H14ClNO4S.
What is the molecular weight of 2-Methyl-8-quinolyl 4-chloro-2-methoxybenzenesulfonate?
The molecular weight of 2-Methyl-8-quinolyl 4-chloro-2-methoxybenzenesulfonate is 363.03 g/mol.
Where can I buy 2-Methyl-8-quinolyl 4-chloro-2-methoxybenzenesulfonate?
You can request a quote for 2-Methyl-8-quinolyl 4-chloro-2-methoxybenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-8-quinolyl 4-chloro-2-methoxybenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-8-quinolyl 4-chloro-2-methoxybenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.