![N-(1-cyano-1,2-dimethylpropyl)-2-{[5-(2-fluorophenyl)-4-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide structure](/static/products/7352/735296-64-7.webp)
N-(1-cyano-1,2-dimethylpropyl)-2-{[5-(2-fluorophenyl)-4-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
TL;DR: N-(1-cyano-1,2-dimethylpropyl)-2-{[5-(2-fluorophenyl)-4-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide (CAS 735296-64-7) is a chemical compound with molecular formula C24H26FN5OS and molecular weight 451.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-cyano-3-methylbutan-2-yl)-2-[[5-(2-fluorophenyl)-4-(2-phenylethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: N-(1-cyano-1,2-dimethylpropyl)-2-{[5-(2-fluorophenyl)-4-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide, N-(2-cyano-3-methylbutan-2-yl)-2-[[5-(2-fluorophenyl)-4-phenethyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
| Molecular Formula | C24H26FN5OS |
|---|---|
| Molecular Weight | 451.18 g/mol |
| LogP | 4.47348 |
| Topological Polar Surface Area | 83.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 451.1842 |
| Heavy Atoms | 32 |
| Complexity | 1109.0774 |
Chemical Identifiers
| CAS Number | 735296-64-7 |
|---|---|
| SMILES | CC(C)C(C)(C#N)NC(=O)CSC1=NN=C(N1CCC2=CC=CC=C2)C3=CC=CC=C3F |
Product Overview
N-(1-cyano-1,2-dimethylpropyl)-2-{[5-(2-fluorophenyl)-4-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide (CAS 735296-64-7), with molecular formula C24H26FN5OS and molecular weight 451.18 g/mol. IUPAC: N-(2-cyano-3-methylbutan-2-yl)-2-[[5-(2-fluorophenyl)-4-(2-phenylethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of N-(1-cyano-1,2-dimethylpropyl)-2-{[5-(2-fluorophenyl)-4-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Property Insights of N-(1-cyano-1,2-dimethylpropyl)-2-{[5-(2-fluorophenyl)-4-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
The XLogP value of 4.47348 indicates that N-(1-cyano-1,2-dimethylpropyl)-2-{[5-(2-fluorophenyl)-4-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.6 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1-cyano-1,2-dimethylpropyl)-2-{[5-(2-fluorophenyl)-4-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide. Following Lipinski's Rule of Five, N-(1-cyano-1,2-dimethylpropyl)-2-{[5-(2-fluorophenyl)-4-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide has 1 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 N-(1-cyano-1,2-dimethylpropyl)-2-{[5-(2-fluorophenyl)-4-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide?
The CAS number of N-(1-cyano-1,2-dimethylpropyl)-2-{[5-(2-fluorophenyl)-4-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide is 735296-64-7.
What is the molecular formula of N-(1-cyano-1,2-dimethylpropyl)-2-{[5-(2-fluorophenyl)-4-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide?
The molecular formula of N-(1-cyano-1,2-dimethylpropyl)-2-{[5-(2-fluorophenyl)-4-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide is C24H26FN5OS.
What is the molecular weight of N-(1-cyano-1,2-dimethylpropyl)-2-{[5-(2-fluorophenyl)-4-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide?
The molecular weight of N-(1-cyano-1,2-dimethylpropyl)-2-{[5-(2-fluorophenyl)-4-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide is 451.18 g/mol.
Where can I buy N-(1-cyano-1,2-dimethylpropyl)-2-{[5-(2-fluorophenyl)-4-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide?
You can request a quote for N-(1-cyano-1,2-dimethylpropyl)-2-{[5-(2-fluorophenyl)-4-(2-phenylethyl)-4H-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-(1-cyano-1,2-dimethylpropyl)-2-{[5-(2-fluorophenyl)-4-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1-cyano-1,2-dimethylpropyl)-2-{[5-(2-fluorophenyl)-4-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.