AC1MWMQJ
3-(4-tert-butylphenyl)-6-(4-nitrophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Also Known As: 3-(4-tert-butylphenyl)-6-(4-nitrophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine|3-(4-(tert-butyl)phenyl)-6-(4-nitrophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
CAS: 714232-95-8
| Molecular Formula | C20H19N5O2S |
|---|---|
| Molecular Weight | 393.12595 g/mol |
| LogP | 4.5089 |
| Topological Polar Surface Area | 86.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 393.12595 |
| Monoisotopic Mass | 393.12595 |
| Heavy Atoms | 28 |
| Complexity | 1063.4707 |
Chemical Identifiers
| CAS Number | 714232-95-8 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C2=NN=C3N2N=C(CS3)C4=CC=C(C=C4)[N+](=O)[O-] |
Product Overview
AC1MWMQJ (CAS 714232-95-8), with molecular formula C20H19N5O2S and molecular weight 393.12595 g/mol. IUPAC: 3-(4-tert-butylphenyl)-6-(4-nitrophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine.
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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