11-[2-[6-[Methyl-[8-[Methyl-[6-[[2-Oxo-2-(6-Oxo-5H-Pyrido[2,3-b][1,4]Benzodiazepin-11-Yl)Ethyl]Amino]Hexyl]Amino]Octyl]Amino]Hexyl-[2-Oxo-2-(6-Oxo-5H-Pyrido[2,3-b][1,4]Benzodiazepin-11-Yl)Ethyl]Amino]Acetyl]-5H-Pyrido[2,3-b][1,4]Benzodiazepin-6-One
[CAS# 152429-64-6]

Identification

• Name: 11-[2-[6-[Methyl-[8-[Methyl-[6-[[2-Oxo-2-(6-Oxo-5H-Pyrido[2,3-b][1,4]Benzodiazepin-11-Yl)Ethyl]Amino]Hexyl]Amino]Octyl]Amino]Hexyl-[2-Oxo-2-(6-Oxo-5H-Pyrido[2,3-b][1,4]Benzodiazepin-11-Yl)Ethyl]Amino]Acetyl]-5H-Pyrido[2,3-b][1,4]Benzodiazepin-6-One
• Synonyms: 11-[2-[6-[Methyl-[8-[Methyl-[6-[[2-Oxo-2-(6-Oxo-5H-Pyrido[2,3-B][1,4]Benzodiazepin-11-Yl)Ethyl]Amino]Hexyl]Amino]Octyl]Amino]Hexyl-[2-Oxo-2-(6-Oxo-5H-Pyrido[2,3-B][1,4]Benzodiazepin-11-Yl)Ethyl]Amino]-1-Oxoethyl]-5H-Pyrido[2,3-B][1,4]Benzodiazepin-6-One; 11-[2-[[2-Keto-2-(6-Keto-5H-Pyrido[2,3-B][1,4]Benzodiazepin-11-Yl)Ethyl]-[6-[8-[6-[[2-Keto-2-(6-Keto-5H-Pyrido[2,3-B][1,4]Benzodiazepin-11-Yl)Ethyl]Amino]Hexyl-Methyl-Amino]Octyl-Methyl-Amino]Hexyl]Amino]Acetyl]-5H-Pyrido[2,3-B][1,4]Benzodiazepin-6-One; 11-[2-[6-[Methyl-[8-[Methyl-[6-[[2-Oxo-2-(6-Oxo-5H-Pyrido[2,3-B][1,4]Benzodiazepin-11-Yl)Ethyl]Amino]Hexyl]Amino]Octyl]Amino]Hexyl-[2-Oxo-2-(6-Oxo-5H-Pyrido[2,3-B][1,4]Benzodiazepin-11-Yl)Ethyl]Amino]Ethanoyl]-5H-Pyrido[2,3-B][1,4]Benzodiazepin-6-One
• Molecular Formula: C₆₄H₇₇N₁₃O₆
• Molecular Weight: 1124.40
• CAS Registry Number: 152429-64-6
• SMILES: C1=CC=CC2=C1N(C3=C(NC2=O)C=CC=N3)C(=O)CN(CC(=O)N4C6=C(C(=O)NC5=C4N=CC=C5)C=CC=C6)CCCCCCN(CCCCCCCCN(CCCCCCNCC(=O)N7C9=C(C(=O)NC8=C7N=CC=C8)C=CC=C9)C)C
• InChI: 1S/C64H77N13O6/c1-72(41-20-8-5-17-35-65-44-56(78)75-53-32-14-11-26-47(53)62(81)69-50-29-23-36-66-59(50)75)39-18-6-3-4-7-19-40-73(2)42-21-9-10-22-43-74(45-57(79)76-54-33-15-12-27-48(54)63(82)70-51-30-24-37-67-60(51)76)46-58(80)77-55-34-16-13-28-49(55)64(83)71-52-31-25-38-68-61(52)77/h11-16,23-34,36-38,65H,3-10,17-22,35,39-46H2,1-2H3,(H,69,81)(H,70,82)(H,71,83)
• InChIKey: YUJOQEAGGUIMED-UHFFFAOYSA-N

Properties

• Density: 1.232g/cm³ (Cal.)