Ubrogepant
[CAS# 1374248-77-7]

Identification

• Name: Ubrogepant
• Synonyms: (3S)-N-[(3S,5S,6R)-6-methyl-2-oxo-5-phenyl-1-(2,2,2-trifluoroethyl)piperidin-3-yl]-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[b]pyridine]-3'-carboxamide
• Molecular Formula: C₂₉H₂₆F₃N₅O₃
• Molecular Weight: 549.54
• CAS Registry Number: 1374248-77-7
• SMILES: C[C@@H]1[C@@H](C[C@@H](C(=O)N1CC(F)(F)F)NC(=O)C2=CC3=C(C[C@@]4(C3)C5=C(NC4=O)N=CC=C5)N=C2)C6=CC=CC=C6

Properties

• Density: 1.5±0.1 g/cm³, Calc.^*
• Index of Refraction: 1.649, Calc.^*
• Boiling Point: 729.4±60.0 ºC (760 mmHg), Calc.^*
• Flash Point: 394.9±32.9 ºC, Calc.^*

^* Calculated using Advanced Chemistry Development (ACD/Labs) Software.