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[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] 3-(dimethylamino)benzoate

[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] 3-(dimethylamino)benzoate structure

CAS No:
391630-11-8
Formula:
C20H22N2O3
Chemical Name:
[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] 3-(dimethylamino)benzoate
Synonyms:
Oprea1_381456;MLS000517026;CHEMBL1524319;HMS2681J23;ZINC3363945;AKOS033618613;MCULE-3595561817;SMR000343159;AB00594738-02;Z18416427;2-oxo-2-(1,2,3,4-tetrahydroisoquinolin-2-yl)ethyl 3-(dimethylamino)benzoate;391630-11-8

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[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] 3-(dimethylamino)benzoate Basic Attributes

Molecular Weight：

338.4 g/mol

Exact Mass：

338.16304257 g/mol

Characteristics

PSA：

49.8 Å²

Water Solubility：

27.9 [ug/mL]

Computed Properties

Molecular Weight:338.4
XLogP3:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:338.16304257
Monoisotopic Mass:338.16304257
Topological Polar Surface Area:49.8
Heavy Atom Count:25
Complexity:480
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of [2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] 3-(dimethylamino)benzoate

Basic Attributes
Characteristics
Computed Properties
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