N-(3-{(2S)-2-Hydroxy-3-[(2-{4-[(Phenylsulfonyl)Amino]Phenyl}Ethyl)Amino]Propoxy}Benzyl)Acetamide
[CAS 244192-94-7]

Identification

• Name: N-(3-{(2S)-2-Hydroxy-3-[(2-{4-[(Phenylsulfonyl)Amino]Phenyl}Ethyl)Amino]Propoxy}Benzyl)Acetamide
• Synonyms: [244192-94-7]; L-748,337; N-[[3-[(2S)-2-Hydroxy-3-[[2-[4-[(phenylsulfonyl)amino]phenyl]ethyl]amino]propoxy]phenyl]methyl]-acetamide
• Molecular Formula: C₂₆H₃₁N₃O₅S
• Molecular Weight: 497.61
• CAS Registry Number: 244192-94-7
• SMILES: CC(=O)NCC1=CC(=CC=C1)OC[C@H](CNCCC2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC=C3)O
• InChI: 1S/C26H31N3O5S/c1-20(30)28-17-22-6-5-7-25(16-22)34-19-24(31)18-27-15-14-21-10-12-23(13-11-21)29-35(32,33)26-8-3-2-4-9-26/h2-13,16,24,27,29,31H,14-15,17-19H2,1H3,(H,28,30)/t24-/m0/s1
• InChIKey: AWIONHVPTYTSHZ-DEOSSOPVSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Refractive index: 1.614 (Cal.)
• solubility: Soluble to 100 mM in DMSO and to 25 mM in ethanol