1-(3-Methyl-3-phenylbutyl)-4-(2-(3-pyridyl)thiazolidin-4-ylcarbonyl)piperazine fumarate
[CAS# 131888-54-5]

Identification

• Name: 1-(3-Methyl-3-phenylbutyl)-4-(2-(3-pyridyl)thiazolidin-4-ylcarbonyl)piperazine fumarate
• Synonyms: But-2-Enedioic Acid; [4-(3-Methyl-3-Phenyl-Butyl)Piperazin-1-Yl]-[2-(3-Pyridyl)Thiazolidin-4-Yl]Methanone; But-2-Enedioic Acid; [4-(3-Methyl-3-Phenylbutyl)-1-Piperazinyl]-[2-(3-Pyridyl)-4-Thiazolidinyl]Methanone; But-2-Enedioic Acid; [4-(3-Methyl-3-Phenyl-Butyl)Piperazin-1-Yl]-(2-Pyridin-3-Yl-1,3-Thiazolidin-4-Yl)Methanone
• Molecular Formula: C₂₈H₃₆N₄O₅S
• Molecular Weight: 540.68
• CAS Registry Number: 131888-54-5
• SMILES: C1=NC=CC=C1C2SCC(N2)C(=O)N3CCN(CC3)CCC(C4=CC=CC=C4)(C)C.O=C(O)\C=C\C(=O)O
• InChI: 1S/C24H32N4OS.C4H4O4/c1-24(2,20-8-4-3-5-9-20)10-12-27-13-15-28(16-14-27)23(29)21-18-30-22(26-21)19-7-6-11-25-17-19;5-3(6)1-2-4(7)8/h3-9,11,17,21-22,26H,10,12-16,18H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1+
• InChIKey: LBPPBLYOJCIZRW-WLHGVMLRSA-N

Properties

• Boiling point: 629.7°C at 760 mmHg (Cal.)
• Flash point: 334.6°C (Cal.)