![N-(2,5-dichlorophenyl)-2-[[5-[4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]phenyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]acetamide structure](/static/products/5886/588684-84-8.webp)
N-(2,5-dichlorophenyl)-2-[[5-[4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]phenyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
TL;DR: N-(2,5-dichlorophenyl)-2-[[5-[4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]phenyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]acetamide (CAS 588684-84-8) is a chemical compound with molecular formula C24H23Cl2N7O3S and molecular weight 559.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,5-dichlorophenyl)-2-[[5-[4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]phenyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: N-(2,5-dichlorophenyl)-2-[[5-[4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]phenyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]acetamide, N-(2,5-dichlorophenyl)-2-(5-{4-[(3,5-dimethyl-4-nitropyrazolyl)methyl]phenyl}- 4-ethyl(1,2,4-triazol-3-ylthio))acetamide, N-(2,5-dichlorophenyl)-2-[(5-{4-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]phenyl}-4-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
| Molecular Formula | C24H23Cl2N7O3S |
|---|---|
| Molecular Weight | 559.10 g/mol |
| LogP | 5.77244 |
| Topological Polar Surface Area | 120.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 559.096 |
| Heavy Atoms | 37 |
| Complexity | 1468.001 |
Chemical Identifiers
| CAS Number | 588684-84-8 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)Cl)Cl)C3=CC=C(C=C3)CN4C(=C(C(=N4)C)[N+](=O)[O-])C |
Product Overview
N-(2,5-dichlorophenyl)-2-[[5-[4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]phenyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]acetamide (CAS 588684-84-8), with molecular formula C24H23Cl2N7O3S and molecular weight 559.10 g/mol. IUPAC: N-(2,5-dichlorophenyl)-2-[[5-[4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]phenyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of N-(2,5-dichlorophenyl)-2-[[5-[4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]phenyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
Property Insights of N-(2,5-dichlorophenyl)-2-[[5-[4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]phenyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
The XLogP value of 5.77244 indicates that N-(2,5-dichlorophenyl)-2-[[5-[4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]phenyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.77 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2,5-dichlorophenyl)-2-[[5-[4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]phenyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]acetamide. Following Lipinski's Rule of Five, N-(2,5-dichlorophenyl)-2-[[5-[4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]phenyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]acetamide has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(2,5-dichlorophenyl)-2-[[5-[4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]phenyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]acetamide?
The CAS number of N-(2,5-dichlorophenyl)-2-[[5-[4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]phenyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]acetamide is 588684-84-8.
What is the molecular formula of N-(2,5-dichlorophenyl)-2-[[5-[4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]phenyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]acetamide?
The molecular formula of N-(2,5-dichlorophenyl)-2-[[5-[4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]phenyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]acetamide is C24H23Cl2N7O3S.
What is the molecular weight of N-(2,5-dichlorophenyl)-2-[[5-[4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]phenyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]acetamide?
The molecular weight of N-(2,5-dichlorophenyl)-2-[[5-[4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]phenyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]acetamide is 559.10 g/mol.
Where can I buy N-(2,5-dichlorophenyl)-2-[[5-[4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]phenyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]acetamide?
You can request a quote for N-(2,5-dichlorophenyl)-2-[[5-[4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]phenyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,5-dichlorophenyl)-2-[[5-[4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]phenyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2,5-dichlorophenyl)-2-[[5-[4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]phenyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.