CBKinase1_011907
TL;DR: CBKinase1_011907 (CAS 832680-82-7) is a chemical compound with molecular formula C21H21N5O2S and molecular weight 407.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-ethyl-5-(1H-indol-3-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methoxyphenyl)acetamide
Also Known As: CBKinase1_011907, CBKinase1_024307, 2-((4-ethyl-5-(1H-indol-3-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(2-methoxyphenyl)acetamide, BRD-K00754205-001-01-8, F0653-0168
| Molecular Formula | C21H21N5O2S |
|---|---|
| Molecular Weight | 407.14 g/mol |
| LogP | 4.1857 |
| Topological Polar Surface Area | 84.83 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 407.1416 |
| Heavy Atoms | 29 |
| Complexity | 1150.9026 |
Chemical Identifiers
| CAS Number | 832680-82-7 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC(=O)NC2=CC=CC=C2OC)C3=CNC4=CC=CC=C43 |
Product Overview
CBKinase1_011907 (CAS 832680-82-7), with molecular formula C21H21N5O2S and molecular weight 407.14 g/mol. IUPAC: 2-[[4-ethyl-5-(1H-indol-3-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methoxyphenyl)acetamide.
Chemical Property Profile of CBKinase1_011907
Property Insights of CBKinase1_011907
The XLogP value of 4.1857 indicates that CBKinase1_011907 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.83 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_011907. Following Lipinski's Rule of Five, CBKinase1_011907 has 2 hydrogen bond donor(s) and 5 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_011907?
The CAS number of CBKinase1_011907 is 832680-82-7.
What is the molecular formula of CBKinase1_011907?
The molecular formula of CBKinase1_011907 is C21H21N5O2S.
What is the molecular weight of CBKinase1_011907?
The molecular weight of CBKinase1_011907 is 407.14 g/mol.
Where can I buy CBKinase1_011907?
You can request a quote for CBKinase1_011907 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_011907?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_011907 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.