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[2-(tert-butylcarbamoylamino)-2-oxoethyl] 1-oxidopyridin-1-ium-4-carboxylate

[2-(tert-butylcarbamoylamino)-2-oxoethyl] 1-oxidopyridin-1-ium-4-carboxylate structure

CAS No:
730941-90-9
Formula:
C13H17N3O5
Chemical Name:
[2-(tert-butylcarbamoylamino)-2-oxoethyl] 1-oxidopyridin-1-ium-4-carboxylate
Synonyms:
MLS001005499;CHEMBL1428319;HMS2684H24;ZINC3302281;AKOS033647341;SMR000384032;Z18881814;4-({2-[(tert-butylcarbamoyl)amino]-2-oxoethoxy}carbonyl)pyridin-1-ium-1-olate;730941-90-9

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[2-(tert-butylcarbamoylamino)-2-oxoethyl] 1-oxidopyridin-1-ium-4-carboxylate Basic Attributes

Molecular Weight：

295.29 g/mol

Exact Mass：

295.11682065 g/mol

Characteristics

PSA：

110 Å²

Water Solubility：

>44.3 [ug/mL]

Computed Properties

Molecular Weight:295.29
XLogP3:0.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:295.11682065
Monoisotopic Mass:295.11682065
Topological Polar Surface Area:110
Heavy Atom Count:21
Complexity:397
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of [2-(tert-butylcarbamoylamino)-2-oxoethyl] 1-oxidopyridin-1-ium-4-carboxylate

Basic Attributes
Characteristics
Computed Properties
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