![4-({[(5-methyl-4H-1,2,4-triazol-3-yl)thio]acetyl}amino)benzoic acid structure](/static/products/696/696622-85-2.png)
4-({[(5-methyl-4H-1,2,4-triazol-3-yl)thio]acetyl}amino)benzoic acid
4-[[2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzoic acid
Also Known As: CBKinase1_011988|CBKinase1_024388|NCGC00101870-01|A3570/0151488|4-({[(5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}amino)benzoic acid|4-({[(5-methyl-4H-1,2,4-triazol-3-yl)thio]acetyl}amino)benzoic acid|4-(2-((5-methyl-4H-1,2,4-triazol-3-yl)thio)acetamido)benzoic acid|4-({2-[(5-METHYL-4H-1,2,4-TRIAZOL-3-YL)SULFANYL]ACETYL}AMINO)BENZOIC ACID|4-[[2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzoic acid
| Molecular Formula | C12H12N4O3S |
|---|---|
| Molecular Weight | 292.06302 g/mol |
| LogP | 1.54212 |
| Topological Polar Surface Area | 107.97 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 292.06302 |
| Monoisotopic Mass | 292.06302 |
| Heavy Atoms | 20 |
| Complexity | 623.8876 |
Chemical Identifiers
| CAS Number | 696622-85-2 |
|---|---|
| SMILES | CC1=NC(=NN1)SCC(=O)NC2=CC=C(C=C2)C(=O)O |
Product Overview
4-({[(5-methyl-4H-1,2,4-triazol-3-yl)thio]acetyl}amino)benzoic acid (CAS 696622-85-2), with molecular formula C12H12N4O3S and molecular weight 292.06302 g/mol. IUPAC: 4-[[2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzoic acid.
4-({[(5-methyl-4H-1,2,4-triazol-3-yl)thio]acetyl}amino)benzoic acid is a custom synthesis product. We offer services from milligram to kilogram scale.
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