3-[2-[4-[Bis(4-Fluorophenyl)Methylene]-1-Piperidinyl]Ethyl]-2,3-Dihydro-2-Thioxo-4(1H)-Quinazolinone
[CAS# 120166-69-0]

Identification

• Name: 3-[2-[4-[Bis(4-Fluorophenyl)Methylene]-1-Piperidinyl]Ethyl]-2,3-Dihydro-2-Thioxo-4(1H)-Quinazolinone
• Synonyms: 3-[2-[4-[Bis(4-Fluorophenyl)Methylene]-1-Piperidyl]Ethyl]-2-Thioxo-1H-Quinazolin-4-One; 3-[2-[4-[Bis(4-Fluorophenyl)Methylene]-1-Piperidinyl]Ethyl]-2-Thioxo-1H-Quinazolin-4-One; R 59 949
• Molecular Formula: C₂₈H₂₅F₂N₃OS
• Molecular Weight: 489.58
• CAS Registry Number: 120166-69-0
• SMILES: C5=C(C(=C3CCN(CCN2C(C1=C(C=CC=C1)NC2=S)=O)CC3)C4=CC=C(C=C4)F)C=CC(=C5)F
• InChI: 1S/C28H25F2N3OS/c29-22-9-5-19(6-10-22)26(20-7-11-23(30)12-8-20)21-13-15-32(16-14-21)17-18-33-27(34)24-3-1-2-4-25(24)31-28(33)35/h1-12H,13-18H2,(H,31,35)
• InChIKey: ZCNBZFRECRPCKU-UHFFFAOYSA-N

Properties

• Density: 1.366g/cm³ (Cal.)
• Boiling point: 637.072°C at 760 mmHg (Cal.)
• Flash point: 339.089°C (Cal.)