2,2-dibromo-N-[1-((6-chloropyridin-3-yl)methyl)pyridin-2(1H)-ylidene]-acetamide

HCID 89613707
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Basic information

Standard SMILES
O=C(N=c1ccccn1Cc1ccc(Cl)nc1)C(Br)Br
InChIKey
KVHVZNYXQMHZJS-UHFFFAOYSA-N
Molecular formula
C13H10Br2ClN3O
Average molar mass
419.5 g/mol

Names & identifiers

Preferred name
2,2-dibromo-N-[1-((6-chloropyridin-3-yl)methyl)pyridin-2(1H)-ylidene]-acetamide
IUPAC
2,2-dibromo-N-[1-[(6-chloro-3-pyridinyl)methyl]-2-pyridinylidene]acetamide

Names & synonyms

SCHEMBL15010614SCHEMBL15010616SCHEMBL29596451KVHVZNYXQMHZJS-UHFFFAOYSA-N2,2-dibromo-N-[1-((6-chloropyridin-3-yl)methyl)pyridin-2(1H)-ylidene]-acetamide

Database identifiers

PubChem CID
89613707

Properties

Computed structural properties

XLogP
3.5
Topological polar surface area
45.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
20

Related reactions

1 records
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Compound notes

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