N-Hydroxy-4-morpholin-4-yl-1,2,5-oxadiazole-3-carboximidoyl chloride

HCID 136335829

Notes Reactions

Substructure search Find similar structures

Basic information

Standard SMILES: ON=C(Cl)c1nonc1N1CCOCC1
InChIKey: CDDDJINFNVOWOR-UHFFFAOYSA-N
Molecular formula: C7H9ClN4O3
Average molar mass: 232.62 g/mol

Names & identifiers

Preferred name: N-Hydroxy-4-morpholin-4-yl-1,2,5-oxadiazole-3-carboximidoyl chloride
IUPAC: N-hydroxy-4-morpholin-4-yl-1,2,5-oxadiazole-3-carboximidoyl chloride

Names & synonyms

SCHEMBL2519862CDDDJINFNVOWOR-UHFFFAOYSA-NN-Hydroxy-4-morpholin-4-yl-1,2,5-oxadiazole-3-carboximidoyl chloride

Database identifiers

PubChem CID: 136335829

Properties

Computed structural properties

XLogP: 0.9
Topological polar surface area: 84 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 7
Rotatable bonds: 2
Heavy atoms: 15
Formal charge: 0
Complexity: 246

Related reactions

8 records

New reaction record

HRID 82739As productuspto-grants-2014_09

HRID 82740As reactantuspto-grants-2014_09

HRID 386842As productuspto-grants-2013_02

HRID 386843As reactantuspto-grants-2013_02

HRID 950637As reactantValidation data from https://doi.org/10.1039/C8SC04228D

HRID 1150251As productTraining data from https://doi.org/10.1039/C8SC04228D (7/10)

HRID 1663501As productuspto-grants-2011_10

HRID 1663502As reactantuspto-grants-2011_10

Compound notes

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