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[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl] 1-oxidopyridin-1-ium-3-carboxylate

[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl] 1-oxidopyridin-1-ium-3-carboxylate structure

CAS No:
732998-80-0
Formula:
C17H14N2O4
Chemical Name:
[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl] 1-oxidopyridin-1-ium-3-carboxylate
Synonyms:
MLS001033200;CHEMBL1586189;HMS2768H04;ZINC3325269;AKOS033631212;SMR000363676;SR-01000049236;SR-01000049236-1;Z18553814;3-{[2-(2-methyl-1H-indol-3-yl)-2-oxoethoxy]carbonyl}pyridin-1-ium-1-olate;732998-80-0

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[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl] 1-oxidopyridin-1-ium-3-carboxylate Basic Attributes

Molecular Weight：

310.30 g/mol

Exact Mass：

310.09535693 g/mol

Characteristics

PSA：

84.6 Å²

Water Solubility：

39.7 [ug/mL]

Computed Properties

Molecular Weight:310.30
XLogP3:1.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:310.09535693
Monoisotopic Mass:310.09535693
Topological Polar Surface Area:84.6
Heavy Atom Count:23
Complexity:456
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of [2-(2-methyl-1H-indol-3-yl)-2-oxoethyl] 1-oxidopyridin-1-ium-3-carboxylate

Basic Attributes
Characteristics
Computed Properties
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