A3057/0129154
TL;DR: A3057/0129154 (CAS 539809-64-8) is a chemical compound with molecular formula C26H24Cl2N4O2S and molecular weight 526.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,6-dichlorophenyl)-2-[[4-phenyl-5-[(4-propylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: A3057/0129154, N-(2,6-dichlorophenyl)-2-({4-phenyl-5-[(4-propylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide, N-(2,6-Dichlorophenyl)-2-((4-phenyl-5-((4-propylphenoxy)methyl)-4H-1,2,4-triazol-3-yl)thio)acetamide, 644-645-1, N-(2,6-Dichlorophenyl)-2-((4-phenyl-5-((4-propylphenoxy)methyl)-4H-1,2,4-triazol-3-YL)sulfanyl)acetamide
| Molecular Formula | C26H24Cl2N4O2S |
|---|---|
| Molecular Weight | 526.10 g/mol |
| LogP | 6.8364 |
| Topological Polar Surface Area | 69.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 526.09973 |
| Heavy Atoms | 35 |
| Complexity | 1260.2688 |
Chemical Identifiers
| CAS Number | 539809-64-8 |
|---|---|
| SMILES | CCCC1=CC=C(C=C1)OCC2=NN=C(N2C3=CC=CC=C3)SCC(=O)NC4=C(C=CC=C4Cl)Cl |
Product Overview
A3057/0129154 (CAS 539809-64-8), with molecular formula C26H24Cl2N4O2S and molecular weight 526.10 g/mol. IUPAC: N-(2,6-dichlorophenyl)-2-[[4-phenyl-5-[(4-propylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of A3057/0129154
Property Insights of A3057/0129154
The XLogP value of 6.8364 indicates that A3057/0129154 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.04 Ų falls within the moderate polarity range, balancing permeability and solubility for A3057/0129154. Following Lipinski's Rule of Five, A3057/0129154 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 A3057/0129154?
The CAS number of A3057/0129154 is 539809-64-8.
What is the molecular formula of A3057/0129154?
The molecular formula of A3057/0129154 is C26H24Cl2N4O2S.
What is the molecular weight of A3057/0129154?
The molecular weight of A3057/0129154 is 526.10 g/mol.
Where can I buy A3057/0129154?
You can request a quote for A3057/0129154 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3057/0129154?
Yes, KEHONG BIO provides custom synthesis services for A3057/0129154 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.