AC1OBTBU
1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-[(E)-3-(furan-2-yl)-2-methylprop-2-enylidene]amino]-5-(4-methylphenyl)triazole-4-carboxamide
Also Known As: (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-((E)-3-(furan-2-yl)-2-methylallylidene)-5-(p-tolyl)-1H-1,2,3-triazole-4-carbohydrazide|1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E,2E)-3-(furan-2-yl)-2-methylprop-2-en-1-ylidene]-5-(4-methylphenyl)-1H-1,2,3-triazole-4-carbohydrazide|1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-[(E)-3-(furan-2-yl)-2-methylprop-2-enylidene]amino]-5-(4-methylphenyl)triazole-4-carboxamide
| Molecular Formula | C20H18N8O3 |
|---|---|
| Molecular Weight | 418.15018 g/mol |
| LogP | 2.62002 |
| Topological Polar Surface Area | 150.25 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 418.15018 |
| Monoisotopic Mass | 418.15018 |
| Heavy Atoms | 31 |
| Complexity | 1250.0929 |
Chemical Identifiers
| CAS Number | 577982-42-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=C(N=NN2C3=NON=C3N)C(=O)N/N=C/C(=C/C4=CC=CO4)/C |
Product Overview
AC1OBTBU (CAS 577982-42-4), with molecular formula C20H18N8O3 and molecular weight 418.15018 g/mol. IUPAC: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-[(E)-3-(furan-2-yl)-2-methylprop-2-enylidene]amino]-5-(4-methylphenyl)triazole-4-carboxamide.