AC1L4JE0
2-[3-(trifluoromethyl)phenyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,2-a]pyridazine-1,3-dione
Also Known As: 2-[3-(trifluoromethyl)phenyl]tetrahydro-1h-[1,2,4]triazolo[1,2-a]pyridazine-1,3(2h)-dione|1H-(1,2,4)Triazolo(1,2-a)pyridazine-1,3(2H)-dione, tetrahydro-2-(4-(alpha,alpha,alpha-trifluoro-p-tolyl))-|2-[3-(trifluoromethyl)phenyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,2-a]pyridazine-1,3-dione|8-[3-(trifluoromethyl)phenyl]-1,6,8-triazabicyclo[4.3.0]nonane-7,9-dione|2-(3-trifluoromethyl-phenyl)-tetrahydro-[1,2,4]triazolo[1,2-a]pyridazine-1,3-dione|2-[3-(Trifluoromethyl)phenyl]perhydro-1,2,4-triazolo[1,2-a]pyridazine-1,3-dione
| Molecular Formula | C13H12F3N3O2 |
|---|---|
| Molecular Weight | 299.08817 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 43.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 299.08817 |
| Monoisotopic Mass | 299.08817 |
| Heavy Atoms | 21 |
| Complexity | 430.0 |
Chemical Identifiers
| CAS Number | 65236-49-9 |
|---|---|
| SMILES | C1CCN2C(=O)N(C(=O)N2C1)C3=CC=CC(=C3)C(F)(F)F |
| InChIKey | AUPITFUPAUXUOV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
AC1L4JE0 (CAS 65236-49-9), with molecular formula C13H12F3N3O2 and molecular weight 299.08817 g/mol. IUPAC: 2-[3-(trifluoromethyl)phenyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,2-a]pyridazine-1,3-dione.
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