AC1OBT8X
4-[(E)-(2-chloro-6-fluorophenyl)methylideneamino]-3-(2-methylphenyl)-1H-1,2,4-triazole-5-thione
Also Known As: (E)-4-((2-chloro-6-fluorobenzylidene)amino)-5-(o-tolyl)-4H-1,2,4-triazole-3-thiol|4-((2-CL-6-FLUOROBENZYLIDENE)AMINO)-5-(2-METHYLPHENYL)-4H-1,2,4-TRIAZOLE-3-THIOL|4-[(E)-(2-chloro-6-fluorophenyl)methylideneamino]-3-(2-methylphenyl)-1H-1,2,4-triazole-5-thione|4-{[(E)-(2-chloro-6-fluorophenyl)methylidene]amino}-5-(2-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
| Molecular Formula | C16H12ClFN4S |
|---|---|
| Molecular Weight | 346.04553 g/mol |
| LogP | 4.59081 |
| Topological Polar Surface Area | 45.97 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 346.04553 |
| Monoisotopic Mass | 346.04553 |
| Heavy Atoms | 23 |
| Complexity | 924.9985 |
Chemical Identifiers
| CAS Number | 488706-84-9 |
|---|---|
| SMILES | CC1=CC=CC=C1C2=NNC(=S)N2/N=C/C3=C(C=CC=C3Cl)F |
Product Overview
AC1OBT8X (CAS 488706-84-9), with molecular formula C16H12ClFN4S and molecular weight 346.04553 g/mol. IUPAC: 4-[(E)-(2-chloro-6-fluorophenyl)methylideneamino]-3-(2-methylphenyl)-1H-1,2,4-triazole-5-thione.
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