5-Chloro-8-quinolyl 5-bromo-2-methoxybenzenesulfonate
TL;DR: 5-Chloro-8-quinolyl 5-bromo-2-methoxybenzenesulfonate (CAS 326885-77-2) is a chemical compound with molecular formula C16H11BrClNO4S and molecular weight 426.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-chloroquinolin-8-yl) 5-bromo-2-methoxybenzenesulfonate
Also Known As: 5-chloro-8-quinolyl 5-bromo-2-methoxybenzenesulfonate, 5-chloroquinolin-8-yl 5-bromo-2-methoxybenzenesulfonate, (5-chloroquinolin-8-yl) 5-bromo-2-methoxybenzenesulfonate
| Molecular Formula | C16H11BrClNO4S |
|---|---|
| Molecular Weight | 426.93 g/mol |
| LogP | 4.427 |
| Topological Polar Surface Area | 65.49 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 426.92807 |
| Heavy Atoms | 24 |
| Complexity | 1023.76117 |
Chemical Identifiers
| CAS Number | 326885-77-2 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)Br)S(=O)(=O)OC2=C3C(=C(C=C2)Cl)C=CC=N3 |
Product Overview
5-Chloro-8-quinolyl 5-bromo-2-methoxybenzenesulfonate (CAS 326885-77-2), with molecular formula C16H11BrClNO4S and molecular weight 426.93 g/mol. IUPAC: (5-chloroquinolin-8-yl) 5-bromo-2-methoxybenzenesulfonate.
Chemical Property Profile of 5-Chloro-8-quinolyl 5-bromo-2-methoxybenzenesulfonate
Property Insights of 5-Chloro-8-quinolyl 5-bromo-2-methoxybenzenesulfonate
The XLogP value of 4.427 indicates that 5-Chloro-8-quinolyl 5-bromo-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 5-Chloro-8-quinolyl 5-bromo-2-methoxybenzenesulfonate. Following Lipinski's Rule of Five, 5-Chloro-8-quinolyl 5-bromo-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 5-Chloro-8-quinolyl 5-bromo-2-methoxybenzenesulfonate?
The CAS number of 5-Chloro-8-quinolyl 5-bromo-2-methoxybenzenesulfonate is 326885-77-2.
What is the molecular formula of 5-Chloro-8-quinolyl 5-bromo-2-methoxybenzenesulfonate?
The molecular formula of 5-Chloro-8-quinolyl 5-bromo-2-methoxybenzenesulfonate is C16H11BrClNO4S.
What is the molecular weight of 5-Chloro-8-quinolyl 5-bromo-2-methoxybenzenesulfonate?
The molecular weight of 5-Chloro-8-quinolyl 5-bromo-2-methoxybenzenesulfonate is 426.93 g/mol.
Where can I buy 5-Chloro-8-quinolyl 5-bromo-2-methoxybenzenesulfonate?
You can request a quote for 5-Chloro-8-quinolyl 5-bromo-2-methoxybenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Chloro-8-quinolyl 5-bromo-2-methoxybenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 5-Chloro-8-quinolyl 5-bromo-2-methoxybenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.