2-[2-(5-Bromo-1H-Indol-3-Yl)Ethyl]-3-(3-Isopropoxyphenyl)-4(3H)-Quinazolinone
[CAS# 133040-77-4]

Identification

• Name: 2-[2-(5-Bromo-1H-Indol-3-Yl)Ethyl]-3-(3-Isopropoxyphenyl)-4(3H)-Quinazolinone
• Synonyms: [133040-77-4]; 2-[2-(5-Bromo-1H-indol-3-yl)-ethyl]-3-(3-isopropoxy-phenyl)-3H-quinazolin-4-one; 2-[2-(5-Bromo-1H-indol-3-yl)ethyl]-3-[3-(1-methylethoxy)phenyl]-4-(3H)-quinazoline
• Molecular Formula: C₂₇H₂₄BrN₃O₂
• Molecular Weight: 502.40
• CAS Registry Number: 133040-77-4
• SMILES: CC(C)OC1=CC=CC(=C1)N2C(=NC3=CC=CC=C3C2=O)CCC4=CNC5=C4C=C(C=C5)Br
• InChI: 1S/C27H24BrN3O2/c1-17(2)33-21-7-5-6-20(15-21)31-26(30-25-9-4-3-8-22(25)27(31)32)13-10-18-16-29-24-12-11-19(28)14-23(18)24/h3-9,11-12,14-17,29H,10,13H2,1-2H3
• InChIKey: KUECXUACQOYKNB-UHFFFAOYSA-N

Properties

• Density: 1.4±0.1g/cm³ (Cal.)
• Boiling point: 690.3±65.0°C at 760 mmHg (Cal.)
• Flash point: 371.3±34.3°C (Cal.)
• Refractive index: 1.667 (Cal.)
• solubility: Soluble to 100 mM in DMSO