AC1OBYSW
4-[(E)-(2,3-dimethoxyphenyl)methylideneamino]-3-(4-fluorophenyl)-1H-1,2,4-triazole-5-thione
Also Known As: (E)-4-((2,3-dimethoxybenzylidene)amino)-5-(4-fluorophenyl)-4H-1,2,4-triazole-3-thiol|4-[(1E)-2-(2,3-dimethoxyphenyl)-1-azavinyl]-5-(4-fluorophenyl)-1,2,4-triazole- 3-thiol|4-[(E)-(2,3-dimethoxyphenyl)methylideneamino]-3-(4-fluorophenyl)-1H-1,2,4-triazole-5-thione|4-{[(E)-(2,3-dimethoxyphenyl)methylidene]amino}-5-(4-fluorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione|4-{[(E)-(2,3-DIMETHOXYPHENYL)METHYLIDENE]AMINO}-5-(4-FLUOROPHENYL)-4H-1,2,4-TRIAZOLE-3-THIOL
| Molecular Formula | C17H15FN4O2S |
|---|---|
| Molecular Weight | 358.08997 g/mol |
| LogP | 3.64619 |
| Topological Polar Surface Area | 64.43 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 358.08997 |
| Monoisotopic Mass | 358.08997 |
| Heavy Atoms | 25 |
| Complexity | 963.52435 |
Chemical Identifiers
| CAS Number | 585563-82-2 |
|---|---|
| SMILES | COC1=CC=CC(=C1OC)/C=N/N2C(=NNC2=S)C3=CC=C(C=C3)F |
Product Overview
AC1OBYSW (CAS 585563-82-2), with molecular formula C17H15FN4O2S and molecular weight 358.08997 g/mol. IUPAC: 4-[(E)-(2,3-dimethoxyphenyl)methylideneamino]-3-(4-fluorophenyl)-1H-1,2,4-triazole-5-thione.
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