AC1OBZ5A
1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-(2-fluorophenyl)methylideneamino]-5-(phenylsulfanylmethyl)triazole-4-carboxamide
Also Known As: (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(2-fluorobenzylidene)-5-((phenylthio)methyl)-1H-1,2,3-triazole-4-carbohydrazide|1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2-fluorophenyl)methylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide|1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-(2-fluorophenyl)methylideneamino]-5-(phenylsulfanylmethyl)triazole-4-carboxamide
| Molecular Formula | C19H15FN8O2S |
|---|---|
| Molecular Weight | 438.10226 g/mol |
| LogP | 2.4278 |
| Topological Polar Surface Area | 137.11 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 438.10226 |
| Monoisotopic Mass | 438.10226 |
| Heavy Atoms | 31 |
| Complexity | 1224.6431 |
Chemical Identifiers
| CAS Number | 587003-89-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)SCC2=C(N=NN2C3=NON=C3N)C(=O)N/N=C/C4=CC=CC=C4F |
Product Overview
AC1OBZ5A (CAS 587003-89-2), with molecular formula C19H15FN8O2S and molecular weight 438.10226 g/mol. IUPAC: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-(2-fluorophenyl)methylideneamino]-5-(phenylsulfanylmethyl)triazole-4-carboxamide.
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