Clk1-IN-4
TL;DR: Clk1-IN-4 (CAS 332939-32-9) is a chemical compound with molecular formula C18H18N2O2S and molecular weight 326.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(8-hydroxyquinolin-7-yl)-thiophen-2-ylmethyl]butanamide
Also Known As: CLK1-IN-4, BAS 01923151, N-((8-Hydroxyquinolin-7-yl)(thiophen-2-yl)methyl)butyramide, N-[(8-hydroxy-7-quinolinyl)(2-thienyl)methyl]butanamide, N-[(8-hydroxyquinolin-7-yl)-thiophen-2-ylmethyl]butanamide
| Molecular Formula | C18H18N2O2S |
|---|---|
| Molecular Weight | 326.11 g/mol |
| LogP | 4.0076 |
| Topological Polar Surface Area | 62.22 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 326.1089 |
| Heavy Atoms | 23 |
| Complexity | 815.00946 |
Chemical Identifiers
| CAS Number | 332939-32-9 |
|---|---|
| SMILES | CCCC(=O)NC(C1=C(C2=C(C=CC=N2)C=C1)O)C3=CC=CS3 |
Product Overview
Clk1-IN-4 (CAS 332939-32-9), with molecular formula C18H18N2O2S and molecular weight 326.11 g/mol. IUPAC: N-[(8-hydroxyquinolin-7-yl)-thiophen-2-ylmethyl]butanamide.
Chemical Property Profile of Clk1-IN-4
Property Insights of Clk1-IN-4
The XLogP value of 4.0076 indicates that Clk1-IN-4 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.22 Ų falls within the moderate polarity range, balancing permeability and solubility for Clk1-IN-4. Following Lipinski's Rule of Five, Clk1-IN-4 has 2 hydrogen bond donor(s) and 4 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 Clk1-IN-4?
The CAS number of Clk1-IN-4 is 332939-32-9.
What is the molecular formula of Clk1-IN-4?
The molecular formula of Clk1-IN-4 is C18H18N2O2S.
What is the molecular weight of Clk1-IN-4?
The molecular weight of Clk1-IN-4 is 326.11 g/mol.
Where can I buy Clk1-IN-4?
You can request a quote for Clk1-IN-4 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Clk1-IN-4?
Yes, KEHONG BIO provides custom synthesis services for Clk1-IN-4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.