3-{[2-(4-Benzyl-1-piperazinyl)ethyl]carbamoyl}-2-pyrazinecarboxylic acid
[CAS# 690626-19-8]

Identification

• Name: 3-{[2-(4-Benzyl-1-piperazinyl)ethyl]carbamoyl}-2-pyrazinecarboxylic acid
• Molecular Formula: C₁₉H₂₃N₅O₃
• Molecular Weight: 369.42
• CAS Registry Number: 690626-19-8
• SMILES: O=C(O)c1nccnc1C(=O)NCCN2CCN(CC2)Cc3ccccc3
• InChI: 1S/C19H23N5O3/c25-18(16-17(19(26)27)21-7-6-20-16)22-8-9-23-10-12-24(13-11-23)14-15-4-2-1-3-5-15/h1-7H,8-14H2,(H,22,25)(H,26,27)
• InChIKey: NJIDZOZYJQNASA-UHFFFAOYSA-N

Properties

• Density: 1.282g/cm³ (Cal.)
• Boiling point: 621.757°C at 760 mmHg (Cal.)
• Flash point: 329.827°C (Cal.)
• Refractive index: 1.614 (Cal.)