AC1LQHB9
6-(4-chlorophenyl)-3-(3-phenyl-1H-pyrazol-5-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Also Known As: NCGC00164752-01|6-(4-chlorophenyl)-3-(3-phenyl-1H-pyrazol-5-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole|6-(4-chlorophenyl)-3-(3-phenylpyrazol-5-yl)-1,2,4-triazolo[3,4-b]1,3,4-thiadia zoline|5-[6-(4-chlorophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]-3-phenyl-1H-pyrazole|6-(4-chlorophenyl)-3-(3-phenyl-1H-pyrazol-5-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
| Molecular Formula | C18H11ClN6S |
|---|---|
| Molecular Weight | 378.04544 g/mol |
| LogP | 4.5633 |
| Topological Polar Surface Area | 71.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 378.04544 |
| Monoisotopic Mass | 378.04544 |
| Heavy Atoms | 26 |
| Complexity | 1189.6306 |
Chemical Identifiers
| CAS Number | 850191-22-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NNC(=C2)C3=NN=C4N3N=C(S4)C5=CC=C(C=C5)Cl |
Product Overview
AC1LQHB9 (CAS 850191-22-9), with molecular formula C18H11ClN6S and molecular weight 378.04544 g/mol. IUPAC: 6-(4-chlorophenyl)-3-(3-phenyl-1H-pyrazol-5-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole.
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