2-[2-Oxo-2-[3-[3-(Piperidin-1-Ylmethyl)Phenoxy]Propylamino]Ethyl]Sulfanylethyl 2-(3-Fluoro-4-Phenylphenyl)Propanoate
[CAS# 135497-86-8]

Identification

• Name: 2-[2-Oxo-2-[3-[3-(Piperidin-1-Ylmethyl)Phenoxy]Propylamino]Ethyl]Sulfanylethyl 2-(3-Fluoro-4-Phenylphenyl)Propanoate
• Synonyms: 2-[2-Oxo-2-[3-[3-(1-Piperidylmethyl)Phenoxy]Propylamino]Ethyl]Sulfanylethyl 2-(3-Fluoro-4-Phenyl-Phenyl)Propanoate; 2-(3-Fluoro-4-Phenylphenyl)Propanoic Acid 2-[[2-Oxo-2-[3-[3-(1-Piperidylmethyl)Phenoxy]Propylamino]Ethyl]Thio]Ethyl Ester; 2-(3-Fluoro-4-Phenyl-Phenyl)Propionic Acid 2-[[2-Keto-2-[3-[3-(Piperidinomethyl)Phenoxy]Propylamino]Ethyl]Thio]Ethyl Ester
• Molecular Formula: C₃₄H₄₁FN₂O₄S
• Molecular Weight: 592.77
• CAS Registry Number: 135497-86-8
• SMILES: C1=C(F)C(=CC=C1C(C(OCCSCC(=O)NCCCOC2=CC(=CC=C2)CN3CCCCC3)=O)C)C4=CC=CC=C4
• InChI: 1S/C34H41FN2O4S/c1-26(29-14-15-31(32(35)23-29)28-11-4-2-5-12-28)34(39)41-20-21-42-25-33(38)36-16-9-19-40-30-13-8-10-27(22-30)24-37-17-6-3-7-18-37/h2,4-5,8,10-15,22-23,26H,3,6-7,9,16-21,24-25H2,1H3,(H,36,38)
• InChIKey: BVNYGFVUPRMYKJ-UHFFFAOYSA-N

Properties

• Density: 1.179g/cm³ (Cal.)
• Boiling point: 740.31°C at 760 mmHg (Cal.)
• Flash point: 401.525°C (Cal.)