Posatirelin
[CAS# 78664-73-0]

Identification

• Name: Posatirelin
• Synonyms: (2S)-N-[(1S)-1-[(2S)-2-Carbamoylpyrrolidine-1-Carbonyl]-3-Methyl-Butyl]-6-Oxo-Piperidine-2-Carboxamide; (2S)-N-[(1S)-1-[[(2S)-2-Carbamoyl-1-Pyrrolidinyl]-Oxomethyl]-3-Methylbutyl]-6-Oxo-2-Piperidinecarboxamide; (2S)-N-[(1S)-1-[(2S)-2-Carbamoylpyrrolidine-1-Carbonyl]-3-Methyl-Butyl]-6-Keto-Pipecolinamide
• Molecular Formula: C₁₇H₂₈N₄O₄
• Molecular Weight: 352.43
• CAS Registry Number: 78664-73-0
• SMILES: [C@@H]2(N(C([C@@H](NC([C@H]1NC(CCC1)=O)=O)CC(C)C)=O)CCC2)C(N)=O
• InChI: 1S/C17H28N4O4/c1-10(2)9-12(17(25)21-8-4-6-13(21)15(18)23)20-16(24)11-5-3-7-14(22)19-11/h10-13H,3-9H2,1-2H3,(H2,18,23)(H,19,22)(H,20,24)/t11-,12-,13-/m0/s1
• InChIKey: DPNGIIPSQYKWQA-AVGNSLFASA-N

Properties

• Density: 1.214g/cm³ (Cal.)
• Boiling point: 739.609°C at 760 mmHg (Cal.)
• Flash point: 401.101°C (Cal.)