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4-amino-N-(6-chloropyridin-2-yl)-1,2,5-oxadiazole-3-carboximidoyl chloride

HCID 58558376
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
Nc1nonc1C(Cl)=Nc1cccc(Cl)n1
InChIKey
GAVVNYKFNJNZST-UHFFFAOYSA-N
Molecular formula
C8H5Cl2N5O
Average molar mass
258.06 g/mol

Names & identifiers

Preferred name
4-amino-N-(6-chloropyridin-2-yl)-1,2,5-oxadiazole-3-carboximidoyl chloride
IUPAC
4-amino-N-(6-chloro-2-pyridinyl)-1,2,5-oxadiazole-3-carboximidoyl chloride

Names & synonyms

SCHEMBL2515695SCHEMBL2515698GAVVNYKFNJNZST-UHFFFAOYSA-N4-amino-N-(6-chloropyridin-2-yl)-1,2,5-oxadiazole-3-carboximidoyl chloride

Database identifiers

PubChem CID
58558376

Properties

Computed structural properties

XLogP
2.3
Topological polar surface area
90.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
2
Heavy atoms
16
Formal charge
0
Complexity
277

Related reactions

4 records
New reaction record
HRID 82721 reaction equation
HRID 82721As productuspto-grants-2014_09
HRID 111125 reaction equation
HRID 111125As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 386824 reaction equation
HRID 386824As productuspto-grants-2013_02
HRID 1663483 reaction equation
HRID 1663483As productuspto-grants-2011_10

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes