AC1N0OM8
methyl 4-[[2-[[4-amino-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate
Also Known As: F2715-0228|methyl 4-(2-{[4-amino-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamido)benzoate|methyl 4-[[2-[[4-amino-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate|methyl 4-(2-((4-amino-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl)thio)acetamido)benzoate|methyl 4-{2-[4-amino-5-(4-methoxyphenyl)-1,2,4-triazol-3-ylthio]acetylamino}be nzoate|methyl 4-[({[4-amino-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
| Molecular Formula | C19H19N5O4S |
|---|---|
| Molecular Weight | 413.11578 g/mol |
| LogP | 2.1849 |
| Topological Polar Surface Area | 121.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 413.11578 |
| Monoisotopic Mass | 413.11578 |
| Heavy Atoms | 29 |
| Complexity | 1002.4439 |
Chemical Identifiers
| CAS Number | 784186-87-4 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=NN=C(N2N)SCC(=O)NC3=CC=C(C=C3)C(=O)OC |
Product Overview
AC1N0OM8 (CAS 784186-87-4), with molecular formula C19H19N5O4S and molecular weight 413.11578 g/mol. IUPAC: methyl 4-[[2-[[4-amino-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate.
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