AC1LSJ3X
2-(4-fluorophenyl)-3,8-dioxo-7-[4-(trifluoromethyl)phenyl]pyrido[3,4-c]pyridazine-4-carbonitrile
Also Known As: KS-00003G7U|9M-916|2-(4-fluorophenyl)-3,8-dioxo-7-[4-(trifluoromethyl)phenyl]-2,3,7,8-tetrahydropyrido[3,4-c]pyridazine-4-carbonitrile|2-(4-fluorophenyl)-3,8-dioxo-7-[4-(trifluoromethyl)phenyl]pyrido[3,4-c]pyridazine-4-carbonitrile|2-(4-fluorophenyl)-3,8-dioxo-7-[4-(trifluoromethyl)phenyl]-2H,3H,7H,8H-pyrido[3,4-c]pyridazine-4-carbonitrile
| Molecular Formula | C21H10F4N4O2 |
|---|---|
| Molecular Weight | 426.07397 g/mol |
| LogP | 3.56618 |
| Topological Polar Surface Area | 80.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 426.07397 |
| Monoisotopic Mass | 426.07397 |
| Heavy Atoms | 31 |
| Complexity | 1462.2502 |
Chemical Identifiers
| CAS Number | 400736-63-2 |
|---|---|
| SMILES | C1=CC(=CC=C1C(F)(F)F)N2C=CC3=C(C(=O)N(N=C3C2=O)C4=CC=C(C=C4)F)C#N |
Product Overview
AC1LSJ3X (CAS 400736-63-2), with molecular formula C21H10F4N4O2 and molecular weight 426.07397 g/mol. IUPAC: 2-(4-fluorophenyl)-3,8-dioxo-7-[4-(trifluoromethyl)phenyl]pyrido[3,4-c]pyridazine-4-carbonitrile.
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