N-(4-(2-Fluorobenzoyl)-1,3-Dimethyl-1H-Pyrazol-5-Yl)-2-((3-(2-Methyl-Piperidin-1-Yl)Propyl)Amino)-Acetamide (Z)-2-Butenedioate (1:1)
[CAS# 105284-38-6]

Identification

• Name: N-(4-(2-Fluorobenzoyl)-1,3-Dimethyl-1H-Pyrazol-5-Yl)-2-((3-(2-Methyl-Piperidin-1-Yl)Propyl)Amino)-Acetamide (Z)-2-Butenedioate (1:1)
• Synonyms: Fp-1; N-(4-(2-Fluorobenzoyl)-1,3-Dimethyl-1H-Pyrazol-5-Yl)-2-((3-(2-Methyl-1-Piperidinyl)Propyl)Amino)Acetamide-2-Butenedioate(1:2); Acetamide, N-(4-(2-Fluorobenzoyl)-1,3-Dimethyl-1H-Pyrazol-5-Yl)-2-((3-(2-Methyl-1-Piperidinyl)Propyl)Amino)-, (Z)-2-Butenedioate (1:1)
• Molecular Formula: C₂₇H₃₆FN₅O₆
• Molecular Weight: 545.61
• CAS Registry Number: 105284-38-6
• SMILES: C3=C(C(=O)C1=C([N](N=C1C)C)NC(=O)CNCCCN2C(CCCC2)C)C(=CC=C3)F.O=C(O)\C=C/C(=O)O
• InChI: 1S/C23H32FN5O2.C4H4O4/c1-16-9-6-7-13-29(16)14-8-12-25-15-20(30)26-23-21(17(2)27-28(23)3)22(31)18-10-4-5-11-19(18)24;5-3(6)1-2-4(7)8/h4-5,10-11,16,25H,6-9,12-15H2,1-3H3,(H,26,30);1-2H,(H,5,6)(H,7,8)/b;2-1-
• InChIKey: YEWBLRAJJWIBJY-BTJKTKAUSA-N

Properties

• Boiling point: 628.4°C at 760 mmHg (Cal.)
• Flash point: 333.8°C (Cal.)