5-Chloro-8-quinolyl 3,4-dimethoxybenzenesulfonate
TL;DR: 5-Chloro-8-quinolyl 3,4-dimethoxybenzenesulfonate (CAS 326885-75-0) is a chemical compound with molecular formula C17H14ClNO5S and molecular weight 379.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-chloroquinolin-8-yl) 3,4-dimethoxybenzenesulfonate
Also Known As: 5-chloro-8-quinolyl 3,4-dimethoxybenzenesulfonate, BAS 02912205, 5-chloroquinolin-8-yl 3,4-dimethoxybenzenesulfonate, (5-chloroquinolin-8-yl) 3,4-dimethoxybenzenesulfonate, 3,4-Dimethoxy-benzenesulfonic acid 5-chloro-quinolin-8-yl ester
| Molecular Formula | C17H14ClNO5S |
|---|---|
| Molecular Weight | 379.03 g/mol |
| LogP | 3.6731 |
| Topological Polar Surface Area | 74.72 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 379.0281 |
| Heavy Atoms | 25 |
| Complexity | 1036.3877 |
Chemical Identifiers
| CAS Number | 326885-75-0 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)S(=O)(=O)OC2=C3C(=C(C=C2)Cl)C=CC=N3)OC |
Product Overview
5-Chloro-8-quinolyl 3,4-dimethoxybenzenesulfonate (CAS 326885-75-0), with molecular formula C17H14ClNO5S and molecular weight 379.03 g/mol. IUPAC: (5-chloroquinolin-8-yl) 3,4-dimethoxybenzenesulfonate.
Chemical Property Profile of 5-Chloro-8-quinolyl 3,4-dimethoxybenzenesulfonate
Property Insights of 5-Chloro-8-quinolyl 3,4-dimethoxybenzenesulfonate
The XLogP value of 3.6731 indicates that 5-Chloro-8-quinolyl 3,4-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 5-Chloro-8-quinolyl 3,4-dimethoxybenzenesulfonate. Following Lipinski's Rule of Five, 5-Chloro-8-quinolyl 3,4-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 5-Chloro-8-quinolyl 3,4-dimethoxybenzenesulfonate?
The CAS number of 5-Chloro-8-quinolyl 3,4-dimethoxybenzenesulfonate is 326885-75-0.
What is the molecular formula of 5-Chloro-8-quinolyl 3,4-dimethoxybenzenesulfonate?
The molecular formula of 5-Chloro-8-quinolyl 3,4-dimethoxybenzenesulfonate is C17H14ClNO5S.
What is the molecular weight of 5-Chloro-8-quinolyl 3,4-dimethoxybenzenesulfonate?
The molecular weight of 5-Chloro-8-quinolyl 3,4-dimethoxybenzenesulfonate is 379.03 g/mol.
Where can I buy 5-Chloro-8-quinolyl 3,4-dimethoxybenzenesulfonate?
You can request a quote for 5-Chloro-8-quinolyl 3,4-dimethoxybenzenesulfonate 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 3,4-dimethoxybenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 5-Chloro-8-quinolyl 3,4-dimethoxybenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.