CBKinase1_008465
TL;DR: CBKinase1_008465 (CAS 696617-84-2) is a chemical compound with molecular formula C23H17N5O2S and molecular weight 427.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(furan-2-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-quinolin-4-ylacetamide
Also Known As: CBKinase1_008465, CBKinase1_020865, A3441/0146076, BRD-K93522288-001-01-7, 2-((5-(furan-2-yl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-N-(quinolin-4-yl)acetamide
| Molecular Formula | C23H17N5O2S |
|---|---|
| Molecular Weight | 427.11 g/mol |
| LogP | 4.8063 |
| Topological Polar Surface Area | 85.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 427.1103 |
| Heavy Atoms | 31 |
| Complexity | 1327.6323 |
Chemical Identifiers
| CAS Number | 696617-84-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC=NC4=CC=CC=C43)C5=CC=CO5 |
Product Overview
CBKinase1_008465 (CAS 696617-84-2), with molecular formula C23H17N5O2S and molecular weight 427.11 g/mol. IUPAC: 2-[[5-(furan-2-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-quinolin-4-ylacetamide.
Chemical Property Profile of CBKinase1_008465
Property Insights of CBKinase1_008465
The XLogP value of 4.8063 indicates that CBKinase1_008465 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.84 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_008465. Following Lipinski's Rule of Five, CBKinase1_008465 has 1 hydrogen bond donor(s) and 6 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_008465?
The CAS number of CBKinase1_008465 is 696617-84-2.
What is the molecular formula of CBKinase1_008465?
The molecular formula of CBKinase1_008465 is C23H17N5O2S.
What is the molecular weight of CBKinase1_008465?
The molecular weight of CBKinase1_008465 is 427.11 g/mol.
Where can I buy CBKinase1_008465?
You can request a quote for CBKinase1_008465 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_008465?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_008465 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.