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2,6-dichloro-N-(pyrimidin-4-yl)benzamide (HCID 59618301)|Huagongshe
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Compound
2,6-dichloro-N-(pyrimidin-4-yl)benzamide
HCID
59618301
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Basic information
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Properties
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Compound notes
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Basic information
Standard SMILES
O=C(Nc1ccncn1)c1c(Cl)cccc1Cl
InChIKey
CTZMEFCSTXRZQV-UHFFFAOYSA-N
Molecular formula
C11H7Cl2N3O
Average molar mass
268.1 g/mol
Names & identifiers
Preferred name
2,6-dichloro-N-(pyrimidin-4-yl)benzamide
IUPAC
2,6-dichloro-N-pyrimidin-4-ylbenzamide
Names & synonyms
2,6-dichloro-N-(pyrimidin-4-yl)benzamide
SCHEMBL1707052
CTZMEFCSTXRZQV-UHFFFAOYSA-N
Database identifiers
PubChem CID
59618301
Properties
Computed structural properties
XLogP
2.9
Topological polar surface area
54.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
17
Formal charge
0
Complexity
267
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Related reactions
2 records
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
109965
As product
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID
449863
As product
uspto-grants-2013_07
Compound notes
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