![Acetamide, 2-[[4-amino-5-(2,4-dichlorophenyl)-4H-1,2,4-triazol-3-yl]thio]-N-[(4-ethoxy-2-nitrophenyl)methyl]- structure](/static/products/5190/519041-86-2.webp)
Acetamide, 2-[[4-amino-5-(2,4-dichlorophenyl)-4H-1,2,4-triazol-3-yl]thio]-N-[(4-ethoxy-2-nitrophenyl)methyl]-
TL;DR: Acetamide, 2-[[4-amino-5-(2,4-dichlorophenyl)-4H-1,2,4-triazol-3-yl]thio]-N-[(4-ethoxy-2-nitrophenyl)methyl]- (CAS 519041-86-2) is a chemical compound with molecular formula C19H18Cl2N6O4S and molecular weight 496.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-amino-5-(2,4-dichlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(4-ethoxy-2-nitrophenyl)methyl]acetamide
Also Known As: Acetamide, 2-[[4-amino-5-(2,4-dichlorophenyl)-4H-1,2,4-triazol-3-yl]thio]-N-[(4-ethoxy-2-nitrophenyl)methyl]-, 2-[[4-amino-5-(2,4-dichlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(4-ethoxy-2-nitrophenyl)methyl]acetamide
| Molecular Formula | C19H18Cl2N6O4S |
|---|---|
| Molecular Weight | 496.05 g/mol |
| LogP | 3.6811 |
| Topological Polar Surface Area | 138.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 496.04874 |
| Heavy Atoms | 32 |
| Complexity | 1156.8418 |
Chemical Identifiers
| CAS Number | 519041-86-2 |
|---|---|
| SMILES | CCOC1=CC(=C(C=C1)CNC(=O)CSC2=NN=C(N2N)C3=C(C=C(C=C3)Cl)Cl)[N+](=O)[O-] |
Product Overview
Acetamide, 2-[[4-amino-5-(2,4-dichlorophenyl)-4H-1,2,4-triazol-3-yl]thio]-N-[(4-ethoxy-2-nitrophenyl)methyl]- (CAS 519041-86-2), with molecular formula C19H18Cl2N6O4S and molecular weight 496.05 g/mol. IUPAC: 2-[[4-amino-5-(2,4-dichlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(4-ethoxy-2-nitrophenyl)methyl]acetamide.
Chemical Property Profile of Acetamide, 2-[[4-amino-5-(2,4-dichlorophenyl)-4H-1,2,4-triazol-3-yl]thio]-N-[(4-ethoxy-2-nitrophenyl)methyl]-
Property Insights of Acetamide, 2-[[4-amino-5-(2,4-dichlorophenyl)-4H-1,2,4-triazol-3-yl]thio]-N-[(4-ethoxy-2-nitrophenyl)methyl]-
The XLogP value of 3.6811 indicates that Acetamide, 2-[[4-amino-5-(2,4-dichlorophenyl)-4H-1,2,4-triazol-3-yl]thio]-N-[(4-ethoxy-2-nitrophenyl)methyl]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 138.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetamide, 2-[[4-amino-5-(2,4-dichlorophenyl)-4H-1,2,4-triazol-3-yl]thio]-N-[(4-ethoxy-2-nitrophenyl)methyl]-. Following Lipinski's Rule of Five, Acetamide, 2-[[4-amino-5-(2,4-dichlorophenyl)-4H-1,2,4-triazol-3-yl]thio]-N-[(4-ethoxy-2-nitrophenyl)methyl]- has 2 hydrogen bond donor(s) and 8 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 Acetamide, 2-[[4-amino-5-(2,4-dichlorophenyl)-4H-1,2,4-triazol-3-yl]thio]-N-[(4-ethoxy-2-nitrophenyl)methyl]-?
The CAS number of Acetamide, 2-[[4-amino-5-(2,4-dichlorophenyl)-4H-1,2,4-triazol-3-yl]thio]-N-[(4-ethoxy-2-nitrophenyl)methyl]- is 519041-86-2.
What is the molecular formula of Acetamide, 2-[[4-amino-5-(2,4-dichlorophenyl)-4H-1,2,4-triazol-3-yl]thio]-N-[(4-ethoxy-2-nitrophenyl)methyl]-?
The molecular formula of Acetamide, 2-[[4-amino-5-(2,4-dichlorophenyl)-4H-1,2,4-triazol-3-yl]thio]-N-[(4-ethoxy-2-nitrophenyl)methyl]- is C19H18Cl2N6O4S.
What is the molecular weight of Acetamide, 2-[[4-amino-5-(2,4-dichlorophenyl)-4H-1,2,4-triazol-3-yl]thio]-N-[(4-ethoxy-2-nitrophenyl)methyl]-?
The molecular weight of Acetamide, 2-[[4-amino-5-(2,4-dichlorophenyl)-4H-1,2,4-triazol-3-yl]thio]-N-[(4-ethoxy-2-nitrophenyl)methyl]- is 496.05 g/mol.
Where can I buy Acetamide, 2-[[4-amino-5-(2,4-dichlorophenyl)-4H-1,2,4-triazol-3-yl]thio]-N-[(4-ethoxy-2-nitrophenyl)methyl]-?
You can request a quote for Acetamide, 2-[[4-amino-5-(2,4-dichlorophenyl)-4H-1,2,4-triazol-3-yl]thio]-N-[(4-ethoxy-2-nitrophenyl)methyl]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetamide, 2-[[4-amino-5-(2,4-dichlorophenyl)-4H-1,2,4-triazol-3-yl]thio]-N-[(4-ethoxy-2-nitrophenyl)methyl]-?
Yes, KEHONG BIO provides custom synthesis services for Acetamide, 2-[[4-amino-5-(2,4-dichlorophenyl)-4H-1,2,4-triazol-3-yl]thio]-N-[(4-ethoxy-2-nitrophenyl)methyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.