5-Chloroquinolin-8-yl 4-chloro-3-nitrobenzenesulfonate
TL;DR: 5-Chloroquinolin-8-yl 4-chloro-3-nitrobenzenesulfonate (CAS 326885-84-1) is a chemical compound with molecular formula C15H8Cl2N2O5S and molecular weight 397.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-chloroquinolin-8-yl) 4-chloro-3-nitrobenzenesulfonate
Also Known As: AB00108692-01, 5-chloroquinolin-8-yl 4-chloro-3-nitrobenzenesulfonate, (5-chloroquinolin-8-yl) 4-chloro-3-nitrobenzenesulfonate, 5-chloro-8-quinolyl 4-chloro-3-nitrobenzenesulfonate
| Molecular Formula | C15H8Cl2N2O5S |
|---|---|
| Molecular Weight | 397.95 g/mol |
| LogP | 4.2175 |
| Topological Polar Surface Area | 99.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 397.9531 |
| Heavy Atoms | 25 |
| Complexity | 1102.2721 |
Chemical Identifiers
| CAS Number | 326885-84-1 |
|---|---|
| SMILES | C1=CC2=C(C=CC(=C2N=C1)OS(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])Cl |
Product Overview
5-Chloroquinolin-8-yl 4-chloro-3-nitrobenzenesulfonate (CAS 326885-84-1), with molecular formula C15H8Cl2N2O5S and molecular weight 397.95 g/mol. IUPAC: (5-chloroquinolin-8-yl) 4-chloro-3-nitrobenzenesulfonate.
Chemical Property Profile of 5-Chloroquinolin-8-yl 4-chloro-3-nitrobenzenesulfonate
Property Insights of 5-Chloroquinolin-8-yl 4-chloro-3-nitrobenzenesulfonate
The XLogP value of 4.2175 indicates that 5-Chloroquinolin-8-yl 4-chloro-3-nitrobenzenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Chloroquinolin-8-yl 4-chloro-3-nitrobenzenesulfonate. Following Lipinski's Rule of Five, 5-Chloroquinolin-8-yl 4-chloro-3-nitrobenzenesulfonate 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-Chloroquinolin-8-yl 4-chloro-3-nitrobenzenesulfonate?
The CAS number of 5-Chloroquinolin-8-yl 4-chloro-3-nitrobenzenesulfonate is 326885-84-1.
What is the molecular formula of 5-Chloroquinolin-8-yl 4-chloro-3-nitrobenzenesulfonate?
The molecular formula of 5-Chloroquinolin-8-yl 4-chloro-3-nitrobenzenesulfonate is C15H8Cl2N2O5S.
What is the molecular weight of 5-Chloroquinolin-8-yl 4-chloro-3-nitrobenzenesulfonate?
The molecular weight of 5-Chloroquinolin-8-yl 4-chloro-3-nitrobenzenesulfonate is 397.95 g/mol.
Where can I buy 5-Chloroquinolin-8-yl 4-chloro-3-nitrobenzenesulfonate?
You can request a quote for 5-Chloroquinolin-8-yl 4-chloro-3-nitrobenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Chloroquinolin-8-yl 4-chloro-3-nitrobenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 5-Chloroquinolin-8-yl 4-chloro-3-nitrobenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.