AC1L6SEK

2-benzoyl-1-[[3-[2-[(2-benzoyl-1-cyanoisoquinolin-1-yl)methyl]-4,5-dimethoxyphenoxy]-4-methoxyphenyl]methyl]isoquinoline-1-carbonitrile

Also Known As: 2-benzoyl-1-[[3-[2-[(2-benzoyl-1-cyanoisoquinolin-1-yl)methyl]-4,5-dimethoxyphenoxy]-4-methoxyphenyl]methyl]isoquinoline-1-carbonitrile|2-benzoyl-1-[[3-[2-[(2-benzoyl-1-cyanoisoquinolin-1-yl)methy|2-Benzoyl-1-[(3-{2-[(2-benzoyl-1-cyano-1,2-dihydroisoquinolin-1-yl)methyl]-4,5-dimethoxyphenoxy}-4-methoxyphenyl)methyl]-1,2-dihydroisoquinoline-1-carbonitrile

Molecular Formula	C51H40N4O6
Molecular Weight	804.2948 g/mol
LogP	9.1
Topological Polar Surface Area	125.0 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	8
Rotatable Bonds	11
Exact Mass	804.2948
Monoisotopic Mass	804.2948
Heavy Atoms	61
Complexity	1690.0

Chemical Identifiers

CAS Number	61306-99-8
SMILES	COC1=C(C=C(C=C1)CC2(C3=CC=CC=C3C=CN2C(=O)C4=CC=CC=C4)C#N)OC5=CC(=C(C=C5CC6(C7=CC=CC=C7C=CN6C(=O)C8=CC=CC=C8)C#N)OC)OC
InChIKey	ZNCQIGIXNMRZOQ-UHFFFAOYSA-N