Anticancer agent 168
TL;DR: Anticancer agent 168 (CAS 207399-56-2) is a chemical compound with molecular formula C16H11ClN2O6 and molecular weight 362.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-chloro-1-ethyl-6-(5-nitrofuran-2-yl)-4-oxoquinoline-3-carboxylic acid
Also Known As: Anticancer agent 168, BIM-0042354.P001, AH-262/41128840, 7-chloro-1-ethyl-6-(5-nitrofuran-2-yl)-4-oxoquinoline-3-carboxylic acid, 7-chloro-1-ethyl-6-{5-nitro-2-furyl}-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid
| Molecular Formula | C16H11ClN2O6 |
|---|---|
| Molecular Weight | 362.03 g/mol |
| LogP | 3.5412 |
| Topological Polar Surface Area | 115.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 362.03058 |
| Heavy Atoms | 25 |
| Complexity | 1082.1538 |
Chemical Identifiers
| CAS Number | 207399-56-2 |
|---|---|
| SMILES | CCN1C=C(C(=O)C2=CC(=C(C=C21)Cl)C3=CC=C(O3)[N+](=O)[O-])C(=O)O |
Product Overview
Anticancer agent 168 (CAS 207399-56-2), with molecular formula C16H11ClN2O6 and molecular weight 362.03 g/mol. IUPAC: 7-chloro-1-ethyl-6-(5-nitrofuran-2-yl)-4-oxoquinoline-3-carboxylic acid.
Chemical Property Profile of Anticancer agent 168
Property Insights of Anticancer agent 168
The XLogP value of 3.5412 indicates that Anticancer agent 168 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.58 Ų falls within the moderate polarity range, balancing permeability and solubility for Anticancer agent 168. Following Lipinski's Rule of Five, Anticancer agent 168 has 1 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 Anticancer agent 168?
The CAS number of Anticancer agent 168 is 207399-56-2.
What is the molecular formula of Anticancer agent 168?
The molecular formula of Anticancer agent 168 is C16H11ClN2O6.
What is the molecular weight of Anticancer agent 168?
The molecular weight of Anticancer agent 168 is 362.03 g/mol.
Where can I buy Anticancer agent 168?
You can request a quote for Anticancer agent 168 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Anticancer agent 168?
Yes, KEHONG BIO provides custom synthesis services for Anticancer agent 168 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.