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2-(4-methoxybenzoyl)-1H-isoquinoline-1-carbonitrile

2-(4-methoxybenzoyl)-1H-isoquinoline-1-carbonitrile structure

CAS No:
58021-73-1
Formula:
C18H14N2O2
Chemical Name:
2-(4-methoxybenzoyl)-1H-isoquinoline-1-carbonitrile
Synonyms:
MLS002920108;58021-73-1;SMR001797705;2-(4-methoxybenzoyl)-1H-isoquinoline-1-carbonitrile;NSC131489;cid_280099;CHEMBL2134376;BDBM93550;DTXSID30299586;AKOS024378909;MCULE-2730647279;NSC-131489;2-p-anisoyl-1H-isoquinoline-1-carbonitrile;ST51023705;AE-018/31860059;2-(4-methoxyphenyl)carbonyl-1H-isoquinoline-1-carbonitrile;1,2-dihydro-2-(4-methoxybenzoyl)isoquinoline-1-carbonitrile;2-(4-methoxybenzoyl)-1,2-dihydro-1-isoquinolinecarbonitrile;2-[(4-methoxyphenyl)-oxomethyl]-1H-isoquinoline-1-carbonitrile;2-[(4-methoxyphenyl)carbonyl]-1,2-dihydroisoquinolinecarbonitrile

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2-(4-methoxybenzoyl)-1H-isoquinoline-1-carbonitrile Basic Attributes

Molecular Weight：

290.3 g/mol

Exact Mass：

290.105527694 g/mol

NSC Number：

131489

DSSTox ID：

DTXSID30299586

Characteristics

PSA：

53.3 Å²

Computed Properties

Molecular Weight:290.3
XLogP3:3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:290.105527694
Monoisotopic Mass:290.105527694
Topological Polar Surface Area:53.3
Heavy Atom Count:22
Complexity:485
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(4-methoxybenzoyl)-1H-isoquinoline-1-carbonitrile

Basic Attributes
Characteristics
Computed Properties

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