AR-196/42727797
TL;DR: AR-196/42727797 (CAS 5321-67-5) is a chemical compound with molecular formula C22H26N4O3S2 and molecular weight 458.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-[(2-ethoxy-4-methylphenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(3-methylsulfanylphenyl)acetamide
Also Known As: AR-196/42727797, 2-({5-[(2-ethoxy-4-methylphenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[3-(methylsulfanyl)phenyl]acetamide, 2-[[5-[(2-ethoxy-4-methylphenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(3-methylsulfanylphenyl)acetamide
| Molecular Formula | C22H26N4O3S2 |
|---|---|
| Molecular Weight | 458.14 g/mol |
| LogP | 4.55392 |
| Topological Polar Surface Area | 78.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 458.14462 |
| Heavy Atoms | 31 |
| Complexity | 1039.3456 |
Chemical Identifiers
| CAS Number | 5321-67-5 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)C)OCC2=NN=C(N2C)SCC(=O)NC3=CC(=CC=C3)SC |
Product Overview
AR-196/42727797 (CAS 5321-67-5), with molecular formula C22H26N4O3S2 and molecular weight 458.14 g/mol. IUPAC: 2-[[5-[(2-ethoxy-4-methylphenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(3-methylsulfanylphenyl)acetamide.
Chemical Property Profile of AR-196/42727797
Property Insights of AR-196/42727797
The XLogP value of 4.55392 indicates that AR-196/42727797 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.27 Ų falls within the moderate polarity range, balancing permeability and solubility for AR-196/42727797. Following Lipinski's Rule of Five, AR-196/42727797 has 1 hydrogen bond donor(s) and 7 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 AR-196/42727797?
The CAS number of AR-196/42727797 is 5321-67-5.
What is the molecular formula of AR-196/42727797?
The molecular formula of AR-196/42727797 is C22H26N4O3S2.
What is the molecular weight of AR-196/42727797?
The molecular weight of AR-196/42727797 is 458.14 g/mol.
Where can I buy AR-196/42727797?
You can request a quote for AR-196/42727797 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AR-196/42727797?
Yes, KEHONG BIO provides custom synthesis services for AR-196/42727797 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.