AC1MQ9R6
[4-amino-6-(4-fluoroanilino)-1,3,5-triazin-2-yl]methyl 4-benzhydrylpiperazine-1-carbodithioate
Also Known As: (4-amino-6-((4-fluorophenyl)amino)-1,3,5-triazin-2-yl)methyl 4-benzhydrylpiperazine-1-carbodithioate|[4-amino-6-(4-fluoroanilino)-1,3,5-triazin-2-yl]methyl 4-benzhydrylpiperazine-1-carbodithioate|{4-amino-6-[(4-fluorophenyl)amino]-1,3,5-triazin-2-yl}methyl 4-(diphenylmethyl)piperazine-1-carbodithioate
CAS: 689751-52-8
| Molecular Formula | C28H28FN7S2 |
|---|---|
| Molecular Weight | 545.18317 g/mol |
| LogP | 5.2618 |
| Topological Polar Surface Area | 83.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 545.18317 |
| Monoisotopic Mass | 545.18317 |
| Heavy Atoms | 38 |
| Complexity | 1309.5082 |
Chemical Identifiers
| CAS Number | 689751-52-8 |
|---|---|
| SMILES | C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=S)SCC4=NC(=NC(=N4)NC5=CC=C(C=C5)F)N |
Product Overview
AC1MQ9R6 (CAS 689751-52-8), with molecular formula C28H28FN7S2 and molecular weight 545.18317 g/mol. IUPAC: [4-amino-6-(4-fluoroanilino)-1,3,5-triazin-2-yl]methyl 4-benzhydrylpiperazine-1-carbodithioate.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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