Itazigrel
[CAS# 70529-35-0]

Identification

• Name: Itazigrel
• Synonyms: 4,5-Bis(4-Methoxyphenyl)-2-(Trifluoromethyl)Thiazole; Ly 108048; Itazogrel
• Molecular Formula: C₁₈H₁₄F₃NO₂S
• Molecular Weight: 365.37
• CAS Registry Number: 70529-35-0
• SMILES: C3=C(C2=C(C1=CC=C(C=C1)OC)SC(=N2)C(F)(F)F)C=CC(=C3)OC
• InChI: 1S/C18H14F3NO2S/c1-23-13-7-3-11(4-8-13)15-16(25-17(22-15)18(19,20)21)12-5-9-14(24-2)10-6-12/h3-10H,1-2H3
• InChIKey: CIPBQTCSXVEDSG-UHFFFAOYSA-N

Properties

• Density: 1.286g/cm³ (Cal.)
• Boiling point: 400.332°C at 760 mmHg (Cal.)
• Flash point: 195.914°C (Cal.)