[4-(4-Fluorophenyl)Sulfonylpiperazin-1-Yl]-[4-[[7-(Trifluoromethyl)Quinolin-4-Yl]Amino]Phenyl]Methanone
[CAS# 72141-57-2]

Identification

• Name: [4-(4-Fluorophenyl)Sulfonylpiperazin-1-Yl]-[4-[[7-(Trifluoromethyl)Quinolin-4-Yl]Amino]Phenyl]Methanone
• Synonyms: [4-(4-Fluorophenyl)Sulfonylpiperazin-1-Yl]-[4-[[7-(Trifluoromethyl)-4-Quinolyl]Amino]Phenyl]Methanone; [4-(4-Fluorophenyl)Sulfonyl-1-Piperazinyl]-[4-[[7-(Trifluoromethyl)-4-Quinolyl]Amino]Phenyl]Methanone; 1-((4-Fluorophenyl)Sulfonyl)-4-(4-((7-(Trifluoromethyl)-4-Quinolinyl)Amino)Benzoyl)Piperazine
• Molecular Formula: C₂₇H₂₂F₄N₄O₃S
• Molecular Weight: 558.55
• CAS Registry Number: 72141-57-2
• SMILES: C1=CC(=CC2=NC=CC(=C12)NC3=CC=C(C=C3)C(N5CCN([S](C4=CC=C(F)C=C4)(=O)=O)CC5)=O)C(F)(F)F
• InChI: 1S/C27H22F4N4O3S/c28-20-4-8-22(9-5-20)39(37,38)35-15-13-34(14-16-35)26(36)18-1-6-21(7-2-18)33-24-11-12-32-25-17-19(27(29,30)31)3-10-23(24)25/h1-12,17H,13-16H2,(H,32,33)
• InChIKey: SYJKIRZBDWNJSB-UHFFFAOYSA-N

Properties

• Density: 1.455g/cm³ (Cal.)
• Boiling point: 695.661°C at 760 mmHg (Cal.)
• Flash point: 374.523°C (Cal.)