AC1MI7E7

N-[4-[1-[2-(4-hexadecoxyphenyl)-4-methyl-3,6-dioxocyclohexa-1,4-dien-1-yl]ethylsulfonyl]phenyl]-4-methoxy-3-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)diazenyl]benzenesulfonamide

Also Known As: EINECS 279-454-9|3-((4,5-Dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo)-N-(4-((1-(2-(4-(hexadecyloxy)phenyl)-4-methyl-3,6-dioxocyclohexa-1,4-dien-1-yl)ethyl)sulphonyl)phenyl)-4-methoxybenzenesulphonamide|N-[4-[1-[2-(4-hexadecoxyphenyl)-4-methyl-3,6-dioxocyclohexa-1,4-dien-1-yl]ethylsulfonyl]phenyl]-4-methoxy-3-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)diazenyl]benzenesulfonamide|3-[(4,5-DIHYDRO-3-METHYL-5-OXO-1-PHENYL-1H-PYRAZOL-4-YL)AZO]-N-[4-[[1-[2-[4-(HEXADECYLOXY)PHENYL]-4-METHYL-3,6-DIOXOCYCLOHEXA-1,4-DIEN-1-YL]ETHYL]SULFONYL]PHENYL]-4-METHOXYBENZENESULFONAMIDE|3-[(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo]-N-[4-[[1-[2-[4-(hexadecyloxy)phenyl]-4-methyl-3,6-dioxocyclohexa-1,4-dien-1-yl]ethyl]sulphonyl]phenyl]-4-methoxybenzenesulphonamide|3-[[(4,5-Dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol)-4-yl]azo]-N-[4-[[1-[2-[4-(hexadecyloxy)phenyl]-4-methyl-3,6-dioxo-1,4-cyclohexadien-1-yl]-ethyl]sulfonyl]phenyl]-4-methoxybenzenesulfonamide|3-[2-(4,5-Dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)diazenyl]-N-[4-[[1-[2-[4-(hexadecyloxy)phenyl]-4-methyl-3,6-dioxo-1,4-cyclohexadien-1-yl]ethyl]sulfonyl]phenyl]-4-methoxybenzenesulfonamide|N-[4-(1-{2-[4-(hexadecyloxy)phenyl]-4-methyl-3,6-dioxocyclohexa-1,4-dien-1-yl}ethanesulfonyl)phenyl]-4-methoxy-3-[2-(3-methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-4-yl)diazen-1-yl]benzene-1-sulfonamide

Molecular Formula	C54H65N5O9S2
Molecular Weight	991.42236 g/mol
LogP	11.9452
Topological Polar Surface Area	190.3 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	12
Rotatable Bonds	27
Exact Mass	991.42236
Monoisotopic Mass	991.42236
Heavy Atoms	70
Complexity	2823.6833

Chemical Identifiers

CAS Number	80396-84-5
SMILES	CCCCCCCCCCCCCCCCOC1=CC=C(C=C1)C2=C(C(=O)C=C(C2=O)C)C(C)S(=O)(=O)C3=CC=C(C=C3)NS(=O)(=O)C4=CC(=C(C=C4)OC)N=NC5C(=NN(C5=O)C6=CC=CC=C6)C