AC1LXJIM
3-(4-chlorophenyl)-6-(3,4,5-trimethoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Also Known As: Oprea1_531597|BAS 12974940|3-(4-chlorophenyl)-6-(3,4,5-trimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole|3-(4-chlorophenyl)-6-(3,4,5-trimethoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole|AO-365/41319905
CAS: 799792-55-5
| Molecular Formula | C18H15ClN4O3S |
|---|---|
| Molecular Weight | 402.05533 g/mol |
| LogP | 4.199 |
| Topological Polar Surface Area | 70.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 402.05533 |
| Monoisotopic Mass | 402.05533 |
| Heavy Atoms | 27 |
| Complexity | 1082.698 |
Chemical Identifiers
| CAS Number | 799792-55-5 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C2=NN3C(=NN=C3S2)C4=CC=C(C=C4)Cl |
Product Overview
AC1LXJIM (CAS 799792-55-5), with molecular formula C18H15ClN4O3S and molecular weight 402.05533 g/mol. IUPAC: 3-(4-chlorophenyl)-6-(3,4,5-trimethoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole.
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.
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