![4-{[4-Amino-5-(3-methoxyphenyl)-1,2,4-triazol-3-ylthio]methyl}benzoic acid structure](/static/products/5777/577786-95-9.webp)
4-{[4-Amino-5-(3-methoxyphenyl)-1,2,4-triazol-3-ylthio]methyl}benzoic acid
4-[[4-amino-5-(3-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzoic acid
Also Known As: 4-{[4-amino-5-(3-methoxyphenyl)-1,2,4-triazol-3-ylthio]methyl}benzoic acid|4-[[4-amino-5-(3-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzoic Acid|4-(((4-amino-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl)thio)methyl)benzoic acid
| Molecular Formula | C17H16N4O3S |
|---|---|
| Molecular Weight | 356.0943 g/mol |
| LogP | 2.658 |
| Topological Polar Surface Area | 103.26 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 356.0943 |
| Monoisotopic Mass | 356.0943 |
| Heavy Atoms | 25 |
| Complexity | 893.1636 |
Chemical Identifiers
| CAS Number | 577786-95-9 |
|---|---|
| SMILES | COC1=CC=CC(=C1)C2=NN=C(N2N)SCC3=CC=C(C=C3)C(=O)O |
Product Overview
4-{[4-Amino-5-(3-methoxyphenyl)-1,2,4-triazol-3-ylthio]methyl}benzoic acid (CAS 577786-95-9), with molecular formula C17H16N4O3S and molecular weight 356.0943 g/mol. IUPAC: 4-[[4-amino-5-(3-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzoic acid.
4-{[4-Amino-5-(3-methoxyphenyl)-1,2,4-triazol-3-ylthio]methyl}benzoic acid is a custom synthesis product. We offer services from milligram to kilogram scale.
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