5-Chloroquinolin-8-yl 3-chlorobenzoate
TL;DR: 5-Chloroquinolin-8-yl 3-chlorobenzoate (CAS 326885-90-9) is a chemical compound with molecular formula C16H9Cl2NO2 and molecular weight 317.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-chloroquinolin-8-yl) 3-chlorobenzoate
Also Known As: 5-chloroquinolin-8-yl 3-chlorobenzoate, 5-chloro-8-quinolyl 3-chlorobenzoate, (5-chloroquinolin-8-yl) 3-chlorobenzoate, F1058-0089
| Molecular Formula | C16H9Cl2NO2 |
|---|---|
| Molecular Weight | 317.00 g/mol |
| LogP | 4.7608 |
| Topological Polar Surface Area | 39.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 317.00104 |
| Heavy Atoms | 21 |
| Complexity | 833.3749 |
Chemical Identifiers
| CAS Number | 326885-90-9 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Cl)C(=O)OC2=C3C(=C(C=C2)Cl)C=CC=N3 |
Product Overview
5-Chloroquinolin-8-yl 3-chlorobenzoate (CAS 326885-90-9), with molecular formula C16H9Cl2NO2 and molecular weight 317.00 g/mol. IUPAC: (5-chloroquinolin-8-yl) 3-chlorobenzoate.
Chemical Property Profile of 5-Chloroquinolin-8-yl 3-chlorobenzoate
Property Insights of 5-Chloroquinolin-8-yl 3-chlorobenzoate
The XLogP value of 4.7608 indicates that 5-Chloroquinolin-8-yl 3-chlorobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.19 Ų, 5-Chloroquinolin-8-yl 3-chlorobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Chloroquinolin-8-yl 3-chlorobenzoate has 0 hydrogen bond donor(s) and 3 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 3-chlorobenzoate?
The CAS number of 5-Chloroquinolin-8-yl 3-chlorobenzoate is 326885-90-9.
What is the molecular formula of 5-Chloroquinolin-8-yl 3-chlorobenzoate?
The molecular formula of 5-Chloroquinolin-8-yl 3-chlorobenzoate is C16H9Cl2NO2.
What is the molecular weight of 5-Chloroquinolin-8-yl 3-chlorobenzoate?
The molecular weight of 5-Chloroquinolin-8-yl 3-chlorobenzoate is 317.00 g/mol.
Where can I buy 5-Chloroquinolin-8-yl 3-chlorobenzoate?
You can request a quote for 5-Chloroquinolin-8-yl 3-chlorobenzoate 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 3-chlorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for 5-Chloroquinolin-8-yl 3-chlorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.