CBKinase1_006592
TL;DR: CBKinase1_006592 (CAS 701274-23-9) is a chemical compound with molecular formula C23H18N4O2S and molecular weight 414.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(1-benzofuran-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-naphthalen-2-ylacetamide
Also Known As: CBKinase1_006592, CBKinase1_018992, BRD-K11630973-001-01-7, 2-[[5-(1-benzofuran-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-naphthalen-2-ylacetamide, 2-{[5-(1-benzofuran-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(naphthalen-2-yl)acetamide
| Molecular Formula | C23H18N4O2S |
|---|---|
| Molecular Weight | 414.12 g/mol |
| LogP | 5.1123 |
| Topological Polar Surface Area | 72.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 414.11505 |
| Heavy Atoms | 30 |
| Complexity | 1339.187 |
Chemical Identifiers
| CAS Number | 701274-23-9 |
|---|---|
| SMILES | CN1C(=NN=C1SCC(=O)NC2=CC3=CC=CC=C3C=C2)C4=CC5=CC=CC=C5O4 |
Product Overview
CBKinase1_006592 (CAS 701274-23-9), with molecular formula C23H18N4O2S and molecular weight 414.12 g/mol. IUPAC: 2-[[5-(1-benzofuran-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-naphthalen-2-ylacetamide.
Chemical Property Profile of CBKinase1_006592
Property Insights of CBKinase1_006592
The XLogP value of 5.1123 indicates that CBKinase1_006592 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.95 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_006592. Following Lipinski's Rule of Five, CBKinase1_006592 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CBKinase1_006592?
The CAS number of CBKinase1_006592 is 701274-23-9.
What is the molecular formula of CBKinase1_006592?
The molecular formula of CBKinase1_006592 is C23H18N4O2S.
What is the molecular weight of CBKinase1_006592?
The molecular weight of CBKinase1_006592 is 414.12 g/mol.
Where can I buy CBKinase1_006592?
You can request a quote for CBKinase1_006592 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_006592?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_006592 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.