DTXSID10864014 structure

DTXSID10864014

2-[[2-methoxy-4-[3-methoxy-4-[[1-(2-methylanilino)-1,3-dioxobutan-2-yl]diazenyl]phenyl]phenyl]diazenyl]-N-(2-methylphenyl)-3-oxobutanamide

CAS: 7147-42-4
Molecular Formula C36H36N6O6
Molecular Weight 648.7 g/mol
LogP 7.5
Topological Polar Surface Area 160.0 A2
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 10
Rotatable Bonds 13
Exact Mass 648.26965
Heavy Atoms 48
Complexity 1080.0

Chemical Identifiers

CAS Number 7147-42-4
SMILES CC1=CC=CC=C1NC(=O)C(C(=O)C)N=NC2=C(C=C(C=C2)C3=CC(=C(C=C3)N=NC(C(=O)C)C(=O)NC4=CC=CC=C4C)OC)OC
InChIKey WYFHUBCFEZAVLO-UHFFFAOYSA-N

📖 Product Overview

DTXSID10864014 (CAS: 7147-42-4) is a chemical compound with molecular formula C36H36N6O6 and molecular weight 648.7 g/mol. Its IUPAC systematic name is 2-[[2-methoxy-4-[3-methoxy-4-[[1-(2-methylanilino)-1,3-dioxobutan-2-yl]diazenyl]phenyl]phenyl]diazenyl]-N-(2-methylphenyl)-3-oxobutanamide. LogP 7.5 Topological Polar Surface Area 160.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 10 Rotatable Bonds 13 Exact Mass 648.26965 Heavy Atoms 48 Complexity 1080.0 InChI Key: WYFHUBCFEZAVLO-UHFFFAOYSA-N. SMILES: CC1=CC=CC=C1NC(=O)C(C(=O)C)N=NC2=C(C=C(C=C2)C3=CC(=C(C=C3)N=NC(C(=O)C)C(=O)NC4=CC=CC=C4C)OC)OC.

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