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2-[2-(2,2-dimethyl-3-oxo-4H-quinoxalin-1-yl)-2-oxoethoxy]benzonitrile

2-[2-(2,2-dimethyl-3-oxo-4H-quinoxalin-1-yl)-2-oxoethoxy]benzonitrile structure

CAS No:
749918-84-1
Formula:
C19H17N3O3
Chemical Name:
2-[2-(2,2-dimethyl-3-oxo-4H-quinoxalin-1-yl)-2-oxoethoxy]benzonitrile
Synonyms:
MLS002248454;SMR001315923;CHEMBL1612648;BDBM83159;cid_2119514;HMS3088E22;ZINC2655832;2-[2-(2,2-dimethyl-3-oxo-4H-quinoxalin-1-yl)-2-oxoethoxy]benzonitrile;AKOS033642168;MCULE-3602651033;SR-01000053430;SR-01000053430-1;Z18769066;2-[2-keto-2-(3-keto-2,2-dimethyl-4H-quinoxalin-1-yl)ethoxy]benzonitrile;2-[2-(2,2-dimethyl-3-oxo-1,2,3,4-tetrahydroquinoxalin-1-yl)-2-oxoethoxy]benzonitrile;2-[2-(2,2-dimethyl-3-oxidanylidene-4H-quinoxalin-1-yl)-2-oxidanylidene-ethoxy]benzenecarbonitrile;749918-84-1

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2-[2-(2,2-dimethyl-3-oxo-4H-quinoxalin-1-yl)-2-oxoethoxy]benzonitrile Basic Attributes

Molecular Weight：

335.4 g/mol

Exact Mass：

335.12699141 g/mol

Characteristics

PSA：

82.4 Å²

Water Solubility：

21.5 [ug/mL]

Computed Properties

Molecular Weight:335.4
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:335.12699141
Monoisotopic Mass:335.12699141
Topological Polar Surface Area:82.4
Heavy Atom Count:25
Complexity:580
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[2-(2,2-dimethyl-3-oxo-4H-quinoxalin-1-yl)-2-oxoethoxy]benzonitrile

Basic Attributes
Characteristics
Computed Properties

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