AC1OBOQZ
4-[(E)-(3-bromo-4-methoxyphenyl)methylideneamino]-3-(2-methylphenyl)-1H-1,2,4-triazole-5-thione
Also Known As: (E)-4-((3-bromo-4-methoxybenzylidene)amino)-5-(o-tolyl)-4H-1,2,4-triazole-3-thiol|4-[(1E)-2-(3-bromo-4-methoxyphenyl)-1-azavinyl]-5-(2-methylphenyl)-1,2,4-triaz ole-3-thiol|4-[(E)-(3-bromo-4-methoxyphenyl)methylideneamino]-3-(2-methylphenyl)-1H-1,2,4-triazole-5-thione|4-{[(E)-(3-bromo-4-methoxyphenyl)methylidene]amino}-5-(2-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione|4-{[(E)-(3-bromo-4-methoxyphenyl)methylidene]amino}-5-(2-methylphenyl)-4H-1,2,4-triazole-3-thiol
| Molecular Formula | C17H15BrN4OS |
|---|---|
| Molecular Weight | 402.01498 g/mol |
| LogP | 4.56941 |
| Topological Polar Surface Area | 55.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 402.01498 |
| Monoisotopic Mass | 402.01498 |
| Heavy Atoms | 24 |
| Complexity | 961.21954 |
Chemical Identifiers
| CAS Number | 488802-40-0 |
|---|---|
| SMILES | CC1=CC=CC=C1C2=NNC(=S)N2/N=C/C3=CC(=C(C=C3)OC)Br |
Product Overview
AC1OBOQZ (CAS 488802-40-0), with molecular formula C17H15BrN4OS and molecular weight 402.01498 g/mol. IUPAC: 4-[(E)-(3-bromo-4-methoxyphenyl)methylideneamino]-3-(2-methylphenyl)-1H-1,2,4-triazole-5-thione.