CBKinase1_008339
TL;DR: CBKinase1_008339 (CAS 496804-63-8) is a chemical compound with molecular formula C18H16FN3OS and molecular weight 341.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(3-fluorophenyl)acetamide
Also Known As: CBKinase1_008339, CBKinase1_020739, BAS 06899916, 2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(3-fluorophenyl)acetamide, AM-807/14146439
| Molecular Formula | C18H16FN3OS |
|---|---|
| Molecular Weight | 341.10 g/mol |
| LogP | 3.70198 |
| Topological Polar Surface Area | 65.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 341.09982 |
| Heavy Atoms | 24 |
| Complexity | 816.39655 |
Chemical Identifiers
| CAS Number | 496804-63-8 |
|---|---|
| SMILES | C1CCC2=NC(=C(C=C2C1)C#N)SCC(=O)NC3=CC(=CC=C3)F |
Product Overview
CBKinase1_008339 (CAS 496804-63-8), with molecular formula C18H16FN3OS and molecular weight 341.10 g/mol. IUPAC: 2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(3-fluorophenyl)acetamide.
Chemical Property Profile of CBKinase1_008339
Property Insights of CBKinase1_008339
The XLogP value of 3.70198 indicates that CBKinase1_008339 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.78 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_008339. Following Lipinski's Rule of Five, CBKinase1_008339 has 1 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 CBKinase1_008339?
The CAS number of CBKinase1_008339 is 496804-63-8.
What is the molecular formula of CBKinase1_008339?
The molecular formula of CBKinase1_008339 is C18H16FN3OS.
What is the molecular weight of CBKinase1_008339?
The molecular weight of CBKinase1_008339 is 341.10 g/mol.
Where can I buy CBKinase1_008339?
You can request a quote for CBKinase1_008339 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_008339?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_008339 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.