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ethyl 4-{[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-4-(methylsulfanyl)butanoyl]amino}benzoate

ethyl 4-{[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-4-(methylsulfanyl)butanoyl]amino}benzoate structure

CAS No:
333443-73-5
Formula:
C22H22N2O5S
Chemical Name:
ethyl 4-{[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-4-(methylsulfanyl)butanoyl]amino}benzoate
Synonyms:
ethyl 4-{[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-4-(methylsulfanyl)butanoyl]amino}benzoate;Oprea1_302175;STL334959;AKOS000749187;AKOS022108509;MCULE-9129976046;ST50260280;AG-690/15437721;ethyl 4-[2-(1,3-dioxobenzo[c]azolin-2-yl)-4-methylthiobutanoylamino]benzoate

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ethyl 4-{[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-4-(methylsulfanyl)butanoyl]amino}benzoate Basic Attributes

Molecular Weight：

426.48548

Exact Mass：

426.125

Characteristics

PSA：

118

XLogP3：

3.1

Computed Properties

Molecular Weight:426.5
XLogP3:3.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:9
Exact Mass:426.12494298
Monoisotopic Mass:426.12494298
Topological Polar Surface Area:118
Heavy Atom Count:30
Complexity:638
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of ethyl 4-{[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-4-(methylsulfanyl)butanoyl]amino}benzoate

Basic Attributes
Characteristics
Computed Properties
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