2-Methyl-8-quinolyl 2-methoxy-4-methyl-5-(methylethyl)benzenesulfonate
TL;DR: 2-Methyl-8-quinolyl 2-methoxy-4-methyl-5-(methylethyl)benzenesulfonate (CAS 425667-63-6) is a chemical compound with molecular formula C21H23NO4S and molecular weight 385.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-methylquinolin-8-yl) 2-methoxy-4-methyl-5-propan-2-ylbenzenesulfonate
Also Known As: 2-methyl-8-quinolyl 2-methoxy-4-methyl-5-(methylethyl)benzenesulfonate, 2-methyl-8-quinolinyl 5-isopropyl-2-methoxy-4-methylbenzenesulfonate, (2-methylquinolin-8-yl) 2-methoxy-4-methyl-5-propan-2-ylbenzenesulfonate
| Molecular Formula | C21H23NO4S |
|---|---|
| Molecular Weight | 385.13 g/mol |
| LogP | 4.75134 |
| Topological Polar Surface Area | 65.49 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 385.13477 |
| Heavy Atoms | 27 |
| Complexity | 1104.6099 |
Chemical Identifiers
| CAS Number | 425667-63-6 |
|---|---|
| SMILES | CC1=NC2=C(C=CC=C2OS(=O)(=O)C3=C(C=C(C(=C3)C(C)C)C)OC)C=C1 |
Product Overview
2-Methyl-8-quinolyl 2-methoxy-4-methyl-5-(methylethyl)benzenesulfonate (CAS 425667-63-6), with molecular formula C21H23NO4S and molecular weight 385.13 g/mol. IUPAC: (2-methylquinolin-8-yl) 2-methoxy-4-methyl-5-propan-2-ylbenzenesulfonate.
Chemical Property Profile of 2-Methyl-8-quinolyl 2-methoxy-4-methyl-5-(methylethyl)benzenesulfonate
Property Insights of 2-Methyl-8-quinolyl 2-methoxy-4-methyl-5-(methylethyl)benzenesulfonate
The XLogP value of 4.75134 indicates that 2-Methyl-8-quinolyl 2-methoxy-4-methyl-5-(methylethyl)benzenesulfonate 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 2-methoxy-4-methyl-5-(methylethyl)benzenesulfonate. Following Lipinski's Rule of Five, 2-Methyl-8-quinolyl 2-methoxy-4-methyl-5-(methylethyl)benzenesulfonate 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 2-methoxy-4-methyl-5-(methylethyl)benzenesulfonate?
The CAS number of 2-Methyl-8-quinolyl 2-methoxy-4-methyl-5-(methylethyl)benzenesulfonate is 425667-63-6.
What is the molecular formula of 2-Methyl-8-quinolyl 2-methoxy-4-methyl-5-(methylethyl)benzenesulfonate?
The molecular formula of 2-Methyl-8-quinolyl 2-methoxy-4-methyl-5-(methylethyl)benzenesulfonate is C21H23NO4S.
What is the molecular weight of 2-Methyl-8-quinolyl 2-methoxy-4-methyl-5-(methylethyl)benzenesulfonate?
The molecular weight of 2-Methyl-8-quinolyl 2-methoxy-4-methyl-5-(methylethyl)benzenesulfonate is 385.13 g/mol.
Where can I buy 2-Methyl-8-quinolyl 2-methoxy-4-methyl-5-(methylethyl)benzenesulfonate?
You can request a quote for 2-Methyl-8-quinolyl 2-methoxy-4-methyl-5-(methylethyl)benzenesulfonate 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 2-methoxy-4-methyl-5-(methylethyl)benzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-8-quinolyl 2-methoxy-4-methyl-5-(methylethyl)benzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.