AC1NQTBX
1-[[[2-[[5-(4-chlorophenyl)-4-phenyl-1H-1,2,4-triazol-4-ium-3-yl]sulfanyl]acetyl]hydrazinylidene]methyl]naphthalen-2-olate
Also Known As: 1-[[[2-[[5-(4-chlorophenyl)-4-phenyl-1H-1,2,4-triazol-4-ium-3-yl]sulfanyl]acetyl]hydrazinylidene]methyl]naphthalen-2-olate|1-{[2-({[5-(4-Chlorophenyl)-4-phenyl-1H-1,2,4-triazol-4-ium-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}naphthalen-2-olate
CAS: 5663-19-4
| Molecular Formula | C27H20ClN5O2S |
|---|---|
| Molecular Weight | 513.1026 g/mol |
| LogP | 4.476 |
| Topological Polar Surface Area | 97.08 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 513.1026 |
| Monoisotopic Mass | 513.1026 |
| Heavy Atoms | 36 |
| Complexity | 1552.3094 |
Chemical Identifiers
| CAS Number | 5663-19-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)[N+]2=C(NN=C2SCC(=O)NN=CC3=C(C=CC4=CC=CC=C43)[O-])C5=CC=C(C=C5)Cl |
Product Overview
AC1NQTBX (CAS 5663-19-4), with molecular formula C27H20ClN5O2S and molecular weight 513.1026 g/mol. IUPAC: 1-[[[2-[[5-(4-chlorophenyl)-4-phenyl-1H-1,2,4-triazol-4-ium-3-yl]sulfanyl]acetyl]hydrazinylidene]methyl]naphthalen-2-olate.
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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