5-Chloroquinolin-8-yl 4-iodobenzoate
TL;DR: 5-Chloroquinolin-8-yl 4-iodobenzoate (CAS 304685-62-9) is a chemical compound with molecular formula C16H9ClINO2 and molecular weight 408.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-chloroquinolin-8-yl) 4-iodobenzoate
Also Known As: 5-chloroquinolin-8-yl 4-iodobenzoate, 5-chloro-8-quinolyl 4-iodobenzoate, BAS 00917312, (5-chloroquinolin-8-yl) 4-iodobenzoate, 4-Iodo-benzoic acid 5-chloro-quinolin-8-yl ester
| Molecular Formula | C16H9ClINO2 |
|---|---|
| Molecular Weight | 408.94 g/mol |
| LogP | 4.712 |
| Topological Polar Surface Area | 39.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 408.93665 |
| Heavy Atoms | 21 |
| Complexity | 818.1249 |
Chemical Identifiers
| CAS Number | 304685-62-9 |
|---|---|
| SMILES | C1=CC2=C(C=CC(=C2N=C1)OC(=O)C3=CC=C(C=C3)I)Cl |
Product Overview
5-Chloroquinolin-8-yl 4-iodobenzoate (CAS 304685-62-9), with molecular formula C16H9ClINO2 and molecular weight 408.94 g/mol. IUPAC: (5-chloroquinolin-8-yl) 4-iodobenzoate.
Chemical Property Profile of 5-Chloroquinolin-8-yl 4-iodobenzoate
Property Insights of 5-Chloroquinolin-8-yl 4-iodobenzoate
The XLogP value of 4.712 indicates that 5-Chloroquinolin-8-yl 4-iodobenzoate 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 4-iodobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Chloroquinolin-8-yl 4-iodobenzoate 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 4-iodobenzoate?
The CAS number of 5-Chloroquinolin-8-yl 4-iodobenzoate is 304685-62-9.
What is the molecular formula of 5-Chloroquinolin-8-yl 4-iodobenzoate?
The molecular formula of 5-Chloroquinolin-8-yl 4-iodobenzoate is C16H9ClINO2.
What is the molecular weight of 5-Chloroquinolin-8-yl 4-iodobenzoate?
The molecular weight of 5-Chloroquinolin-8-yl 4-iodobenzoate is 408.94 g/mol.
Where can I buy 5-Chloroquinolin-8-yl 4-iodobenzoate?
You can request a quote for 5-Chloroquinolin-8-yl 4-iodobenzoate 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-iodobenzoate?
Yes, KEHONG BIO provides custom synthesis services for 5-Chloroquinolin-8-yl 4-iodobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.