N-{7-[(4-Aminobutyl)Amino]Heptyl}-Nalpha-Butyryl-L-Tyrosinamide Dihydrochloride
[CAS# 401601-12-5]

Identification

• Name: N-{7-[(4-Aminobutyl)Amino]Heptyl}-Nalpha-Butyryl-L-Tyrosinamide Dihydrochloride
• Synonyms: "N-[7-[(4-aminobutyl)amino]heptyl]-4-hydroxy-?S-[(1-oxobutyl)amino]-benzenepropanamide, dihydrochloride"; (S)-N-[7-[(4-Aminobutyl)amino]heptyl]-4-hydroxy-a-[(1-oxobutyl)amino]benzenepropanamide dihydrochloride
• Molecular Formula: C₂₄H₄₄Cl₂N₄O₃
• Molecular Weight: 507.54
• CAS Registry Number: 401601-12-5
• SMILES: CCCC(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)NCCCCCCCNCCCCN.Cl.Cl
• InChI: 1S/C24H42N4O3.2ClH/c1-2-10-23(30)28-22(19-20-11-13-21(29)14-12-20)24(31)27-18-8-5-3-4-7-16-26-17-9-6-15-25;;/h11-14,22,26,29H,2-10,15-19,25H2,1H3,(H,27,31)(H,28,30);2*1H/t22-;;/m0../s1
• InChIKey: HWTJQQMIKVJWLH-IKXQUJFKSA-N

Properties

• Refractive index: (Cal.)
• solubility: Soluble to 100 mM in water and to 100 mM in DMSO