N-[2-(4-{Benzyl[2-(Hydroxycarbamoyl)-4,6-Dimethylphenyl]Sulfamoyl}Phenoxy)Ethyl]-1-Benzofuran-2-Carboxamide
[CAS# 307002-73-9]

Identification

• Name: N-[2-(4-{Benzyl[2-(Hydroxycarbamoyl)-4,6-Dimethylphenyl]Sulfamoyl}Phenoxy)Ethyl]-1-Benzofuran-2-Carboxamide
• Synonyms: [307002-73-9]; Benzofuran-2-carboxylic acid (2-{4-[benzyl-(2-hydroxycarbamoyl-4,6-dimethyl-phenyl)-sulfamoyl]-phenoxy}-ethyl)-amide; N-[2-[4-[[[2-[(Hydroxyamino)carbonyl]-4,6-dimethylphenyl](phenylmethyl)amino]sulfonyl]phenoxy]ethyl]-2-benzofurancarboxamide
• Molecular Formula: C₃₃H₃₁N₃O₇S
• Molecular Weight: 613.68
• CAS Registry Number: 307002-73-9
• SMILES: CC1=CC(=C(C(=C1)C(=O)NO)N(CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)OCCNC(=O)C4=CC5=CC=CC=C5O4)C
• InChI: 1S/C33H31N3O7S/c1-22-18-23(2)31(28(19-22)32(37)35-39)36(21-24-8-4-3-5-9-24)44(40,41)27-14-12-26(13-15-27)42-17-16-34-33(38)30-20-25-10-6-7-11-29(25)43-30/h3-15,18-20,39H,16-17,21H2,1-2H3,(H,34,38)(H,35,37)
• InChIKey: FARMEEAGJWMFSZ-UHFFFAOYSA-N

Properties

• Density: 1.4±0.1g/cm³ (Cal.)
• Refractive index: 1.656 (Cal.)
• solubility: Soluble to 100 mM in DMSO and to 100 mM in ethanol