N-(5-chloro-2-methoxyphenyl)-2-(4H-1,2,4-triazol-3-ylsulfanyl)acetamide
TL;DR: N-(5-chloro-2-methoxyphenyl)-2-(4H-1,2,4-triazol-3-ylsulfanyl)acetamide (CAS 481718-78-9) is a chemical compound with molecular formula C11H11ClN4O2S and molecular weight 298.0291 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(5-chloro-2-methoxyphenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide
Also Known As: 2-((4H-1,2,4-triazol-3-yl)thio)-N-(5-chloro-2-methoxyphenyl)acetamide, N-(5-chloro-2-methoxyphenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide, N-(5-chloro-2-methoxyphenyl)-2-(4H-1,2,4-triazol-3-ylsulfanyl)acetamide, N-(5-chloro-2-methoxyphenyl)-2-(4H-1,2,4-triazol-3-ylthio)acetamide
Technical Specifications
| Molecular Formula | C11H11ClN4O2S |
| Molecular Weight | 298.0291 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 105.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 298.0291 Da |
| Heavy Atoms | 19 |
| Complexity | 310.0 |
| SMILES | COC1=C(C=C(C=C1)Cl)NC(=O)CSC2=NC=NN2 |
| InChIKey | VMCACIBXHWDVLU-UHFFFAOYSA-N |
Chemical Property Profile of N-(5-chloro-2-methoxyphenyl)-2-(4H-1,2,4-triazol-3-ylsulfanyl)acetamide
Property Insights of N-(5-chloro-2-methoxyphenyl)-2-(4H-1,2,4-triazol-3-ylsulfanyl)acetamide
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(5-chloro-2-methoxyphenyl)-2-(4H-1,2,4-triazol-3-ylsulfanyl)acetamide. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(5-chloro-2-methoxyphenyl)-2-(4H-1,2,4-triazol-3-ylsulfanyl)acetamide. Following Lipinski's Rule of Five, N-(5-chloro-2-methoxyphenyl)-2-(4H-1,2,4-triazol-3-ylsulfanyl)acetamide has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-(5-chloro-2-methoxyphenyl)-2-(4H-1,2,4-triazol-3-ylsulfanyl)acetamide?
The CAS number of N-(5-chloro-2-methoxyphenyl)-2-(4H-1,2,4-triazol-3-ylsulfanyl)acetamide is 481718-78-9.
What is the molecular formula of N-(5-chloro-2-methoxyphenyl)-2-(4H-1,2,4-triazol-3-ylsulfanyl)acetamide?
The molecular formula of N-(5-chloro-2-methoxyphenyl)-2-(4H-1,2,4-triazol-3-ylsulfanyl)acetamide is C11H11ClN4O2S.
What is the molecular weight of N-(5-chloro-2-methoxyphenyl)-2-(4H-1,2,4-triazol-3-ylsulfanyl)acetamide?
The molecular weight of N-(5-chloro-2-methoxyphenyl)-2-(4H-1,2,4-triazol-3-ylsulfanyl)acetamide is 298.0291 g/mol.
Where can I buy N-(5-chloro-2-methoxyphenyl)-2-(4H-1,2,4-triazol-3-ylsulfanyl)acetamide?
You can request a quote for N-(5-chloro-2-methoxyphenyl)-2-(4H-1,2,4-triazol-3-ylsulfanyl)acetamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(5-chloro-2-methoxyphenyl)-2-(4H-1,2,4-triazol-3-ylsulfanyl)acetamide?
Yes, CoreyChem provides custom synthesis services for N-(5-chloro-2-methoxyphenyl)-2-(4H-1,2,4-triazol-3-ylsulfanyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.