AC1NNGRU
[3,5-bis(difluoromethyl)-5-hydroxy-4H-pyrazol-1-yl]-[2-(3-bromophenyl)quinolin-4-yl]methanone
Also Known As: AK-968/41924665|[3,5-bis(difluoromethyl)-5-hydroxy-4H-pyrazol-1-yl]-[2-(3-bromophenyl)quinolin-4-yl]methanone|[3,5-bis(difluoromethyl)-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl][2-(3-bromophenyl)quinolin-4-yl]methanone|3,5-bis(difluoromethyl)-5-hydroxy(2-pyrazolinyl) 2-(3-bromophenyl)(4-quinolyl) ketone|1-{[2-(3-bromophenyl)-4-quinolinyl]carbonyl}-3,5-bis(difluoromethyl)-4,5-dihydro-1H-pyrazol-5-ol
CAS: 438232-03-2
| Molecular Formula | C21H14BrF4N3O2 |
|---|---|
| Molecular Weight | 495.02054 g/mol |
| LogP | 5.085 |
| Topological Polar Surface Area | 65.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 495.02054 |
| Monoisotopic Mass | 495.02054 |
| Heavy Atoms | 31 |
| Complexity | 1204.2134 |
Chemical Identifiers
| CAS Number | 438232-03-2 |
|---|---|
| SMILES | C1C(=NN(C1(C(F)F)O)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC(=CC=C4)Br)C(F)F |
Product Overview
AC1NNGRU (CAS 438232-03-2), with molecular formula C21H14BrF4N3O2 and molecular weight 495.02054 g/mol. IUPAC: [3,5-bis(difluoromethyl)-5-hydroxy-4H-pyrazol-1-yl]-[2-(3-bromophenyl)quinolin-4-yl]methanone.
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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