Products 246146-55-4

CAS 246146-55-4 appears in our catalog under these names: BIIE 0246, BIIE-0246, BIIE 0246, BIIE-0246, 99.10%, BIIE-0246 (Standard). Offered by: TRC, TargetMol, GLPBio, Biosynth, Chemat. Available pack sizes: 50mg, 2mg, 1mg, 10mg, 100mg, 5mg, 50 mg, 10 mg.

Structural formula: {0} (CAS {1})

(2S)-5-(diaminomethylideneamino)-N-[2-(3,5-dioxo-1,2-diphenyl-1,2,4-triazolidin-4-yl)ethyl]-2-[[2-[1-[2-oxo-2-[4-(6-oxo-5,11-dihydrobenzo[c][1]benzazepin-11-yl)piperazin-1-yl]ethyl]cyclopentyl]acetyl]amino]pentanamide (CAS 246146-55-4) is a chemical compound with the molecular formula C49H57N11O6 and a molecular weight of 896.0 g/mol. IUPAC name: (2S)-5-(diaminomethylideneamino)-N-[2-(3,5-dioxo-1,2-diphenyl-1,2,4-triazolidin-4-yl)ethyl]-2-[[2-[1-[2-oxo-2-[4-(6-oxo-5,11-dihydrobenzo[c][1]benzazepin-11-yl)piperazin-1-yl]ethyl]cyclopentyl]acetyl]amino]pentanamide. InChIKey: RSJAXPUYVJKAAA-JPGJPTAESA-N.

Identity
Molecular formulaC49H57N11O6
Molecular weight896.0 g/mol
IUPAC name(2S)-5-(diaminomethylideneamino)-N-[2-(3,5-dioxo-1,2-diphenyl-1,2,4-triazolidin-4-yl)ethyl]-2-[[2-[1-[2-oxo-2-[4-(6-oxo-5,11-dihydrobenzo[c][1]benzazepin-11-yl)piperazin-1-yl]ethyl]cyclopentyl]acetyl]amino]pentanamide
InChIKeyRSJAXPUYVJKAAA-JPGJPTAESA-N
SMILESC1CCC(C1)(CC(=O)N[C@@H](CCCN=C(N)N)C(=O)NCCN2C(=O)N(N(C2=O)C3=CC=CC=C3)C4=CC=CC=C4)CC(=O)N5CCN(CC5)C6C7=CC=CC=C7C(=O)NC8=CC=CC=C68

Computed by PubChem (NCBI)