![4-chloro-2-{2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamido}benzoic acid structure](/static/products/5651/565166-34-9.webp)
4-chloro-2-{2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamido}benzoic acid
4-chloro-2-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzoic acid
Also Known As: 4-chloro-2-{2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamido}benzoic acid|4-Chloro-2-[2-(4-methyl-4H-[1,2,4]triazol-3-ylsulfanyl)-acetylamino]-benzoic acid|SR-01000039817-1|4-chloro-2-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzoic Acid|4-Chloro-2-[[2-[(4-methyl-4H-1,2,4-triazol-3-yl)thio]acetyl]amino]benzoic acid|4-chloro-2-{2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetamido}benzoic acid|4-chloro-2-{2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamido}benzoicacid
| Molecular Formula | C12H11ClN4O3S |
|---|---|
| Molecular Weight | 326.02405 g/mol |
| LogP | 1.8975 |
| Topological Polar Surface Area | 97.11 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 326.02405 |
| Monoisotopic Mass | 326.02405 |
| Heavy Atoms | 21 |
| Complexity | 688.8921 |
Chemical Identifiers
| CAS Number | 565166-34-9 |
|---|---|
| SMILES | CN1C=NN=C1SCC(=O)NC2=C(C=CC(=C2)Cl)C(=O)O |
Product Overview
4-chloro-2-{2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamido}benzoic acid (CAS 565166-34-9), with molecular formula C12H11ClN4O3S and molecular weight 326.02405 g/mol. IUPAC: 4-chloro-2-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzoic acid.