RefChem:561480 structure

RefChem:561480

N-[5-[[4-[(5-benzamido-9,10-dioxoanthracen-1-yl)amino]-6-chloro-1,3,5-triazin-2-yl]amino]-9,10-dioxoanthracen-1-yl]benzamide

Also Known As: EINECS 256-415-4|N,N'-((6-Chloro-1,3,5-triazine-2,4-diyl)bis(imino(9,10-dihydro-9,10-dioxoanthracene-5,1-diyl)))bis(benzamide)|Benzamide, N,N'-[(6-chloro-1,3,5-triazine-2,4-diyl)bis[imino(9,10-dihydro-9,10-dioxo-5,1-anthracenediyl)]]bis-|N,N'-[(6-CHLORO-1,3,5-TRIAZINE-2,4-DIYL)BIS[IMINO(9,10-DIHYDRO-9,10-DIOXOANTHRACENE-5,1-DIYL)]]BIS(BENZAMIDE)|N-[5-[[4-[(5-benzamido-9,10-dioxoanthracen-1-yl)amino]-6-chloro-1,3,5-triazin-2-yl]amino]-9,10-dioxoanthracen-1-yl]benzamide|Benzamide, N,N'-((6-chloro-1,3,5-triazine-2,4-diyl)bis(imino(9,10-dihydro-9,10-dioxo-5,1-anthracenediyl)))bis-|N,N -[(6-Chloro-1,3,5-triazine-2,4-diyl)bis[imino[(9,10-dihydro-9,10-dioxoanthracene)-5,1-diyl]]]bisbenzamide|N,N'-{(6-Chloro-1,3,5-triazine-2,4-diyl)bis[azanediyl(9,10-dioxo-9,10-dihydroanthracene-5,1-diyl)]}dibenzamide|N-[5-({4-[(5-BENZAMIDO-9,10-DIOXO-9,10-DIHYDROANTHRACEN-1-YL)AMINO]-6-CHLORO-1,3,5-TRIAZIN-2-YL}AMINO)-9,10-DIOXO-9,10-DIHYDROANTHRACEN-1-YL]BENZAMIDE

CAS: 49658-80-2
Molecular Formula C45H26ClN7O6
Molecular Weight 795.1633 g/mol
LogP 8.0676
Topological Polar Surface Area 189.21 Ų
Hydrogen Bond Donors 4
Hydrogen Bond Acceptors 11
Rotatable Bonds 8
Exact Mass 795.1633
Monoisotopic Mass 795.1633
Heavy Atoms 59
Complexity 2777.6973

Chemical Identifiers

CAS Number 49658-80-2
SMILES C1=CC=C(C=C1)C(=O)NC2=CC=CC3=C2C(=O)C4=C(C3=O)C(=CC=C4)NC5=NC(=NC(=N5)Cl)NC6=CC=CC7=C6C(=O)C8=C(C7=O)C(=CC=C8)NC(=O)C9=CC=CC=C9

Product Overview

RefChem:561480 (CAS 49658-80-2), with molecular formula C45H26ClN7O6 and molecular weight 795.1633 g/mol. IUPAC: N-[5-[[4-[(5-benzamido-9,10-dioxoanthracen-1-yl)amino]-6-chloro-1,3,5-triazin-2-yl]amino]-9,10-dioxoanthracen-1-yl]benzamide.

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