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[2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 1-oxidopyridin-1-ium-4-carboxylate

[2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 1-oxidopyridin-1-ium-4-carboxylate structure

CAS No:
568557-89-1
Formula:
C12H15N3O5
Chemical Name:
[2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 1-oxidopyridin-1-ium-4-carboxylate
Synonyms:
MLS000516287;CHEMBL1494424;HMS2708F24;ZINC3276635;AKOS033647349;SMR000372938;Z18881841;4-[(2-oxo-2-{[(propan-2-yl)carbamoyl]amino}ethoxy)carbonyl]pyridin-1-ium-1-olate;568557-89-1

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[2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 1-oxidopyridin-1-ium-4-carboxylate Basic Attributes

Molecular Weight：

281.26 g/mol

Exact Mass：

281.10117059 g/mol

Characteristics

PSA：

110 Å²

Water Solubility：

>42.2 [ug/mL]

Computed Properties

Molecular Weight:281.26
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:281.10117059
Monoisotopic Mass:281.10117059
Topological Polar Surface Area:110
Heavy Atom Count:20
Complexity:364
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of [2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 1-oxidopyridin-1-ium-4-carboxylate

Basic Attributes
Characteristics
Computed Properties
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