CBKinase1_008538
TL;DR: CBKinase1_008538 (CAS 626227-77-8) is a chemical compound with molecular formula C20H17ClF3N3OS and molecular weight 439.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-chloro-2-methylphenyl)-2-[[3-cyano-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl]acetamide
Also Known As: CBKinase1_008538, CBKinase1_020938, AM-807/41625934, BRD-K38386112-001-01-7, N-(5-chloro-2-methylphenyl)-2-[[3-cyano-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl]acetamide
| Molecular Formula | C20H17ClF3N3OS |
|---|---|
| Molecular Weight | 439.07 g/mol |
| LogP | 5.5435 |
| Topological Polar Surface Area | 65.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 439.0733 |
| Heavy Atoms | 29 |
| Complexity | 1001.93176 |
Chemical Identifiers
| CAS Number | 626227-77-8 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)Cl)NC(=O)CSC2=NC3=C(CCCC3)C(=C2C#N)C(F)(F)F |
Product Overview
CBKinase1_008538 (CAS 626227-77-8), with molecular formula C20H17ClF3N3OS and molecular weight 439.07 g/mol. IUPAC: N-(5-chloro-2-methylphenyl)-2-[[3-cyano-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl]acetamide.
Chemical Property Profile of CBKinase1_008538
Property Insights of CBKinase1_008538
The XLogP value of 5.5435 indicates that CBKinase1_008538 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_008538. Following Lipinski's Rule of Five, CBKinase1_008538 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CBKinase1_008538?
The CAS number of CBKinase1_008538 is 626227-77-8.
What is the molecular formula of CBKinase1_008538?
The molecular formula of CBKinase1_008538 is C20H17ClF3N3OS.
What is the molecular weight of CBKinase1_008538?
The molecular weight of CBKinase1_008538 is 439.07 g/mol.
Where can I buy CBKinase1_008538?
You can request a quote for CBKinase1_008538 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_008538?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_008538 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.