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2-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethoxy]benzonitrile

2-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethoxy]benzonitrile structure

CAS No:
791092-68-7
Formula:
C20H20N2O4
Chemical Name:
2-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethoxy]benzonitrile
Synonyms:
791092-68-7;MLS001214662;CHEMBL1431990;HMS2855K09;ZINC2332196;STK588372;AKOS001213917;MCULE-1408153119;SMR000543626;Z29864379;2-[2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-yl)-2-oxoethoxy]benzonitrile;2-[2-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethoxy]benzonitrile

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2-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethoxy]benzonitrile Basic Attributes

Molecular Weight：

352.4 g/mol

Exact Mass：

352.14230712 g/mol

Characteristics

PSA：

71.8 Å²

Water Solubility：

15 [ug/mL]

Computed Properties

Molecular Weight:352.4
XLogP3:2.6
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:352.14230712
Monoisotopic Mass:352.14230712
Topological Polar Surface Area:71.8
Heavy Atom Count:26
Complexity:531
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethoxy]benzonitrile

Basic Attributes
Characteristics
Computed Properties

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