3-chloro-4-fluoro-N-(5-nitropyrimidin-2-yl)benzamide

HCID 57447263
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Basic information

Standard SMILES
O=C(Nc1ncc([N+](=O)[O-])cn1)c1ccc(F)c(Cl)c1
InChIKey
AOEKXNFMGMGOCC-UHFFFAOYSA-N
Molecular formula
C11H6ClFN4O3
Average molar mass
296.64 g/mol

Names & identifiers

Preferred name
3-chloro-4-fluoro-N-(5-nitropyrimidin-2-yl)benzamide
IUPAC
3-chloro-4-fluoro-N-(5-nitropyrimidin-2-yl)benzamide

Names & synonyms

SCHEMBL1942220AOEKXNFMGMGOCC-UHFFFAOYSA-N3-chloro-4-fluoro-N-(5-nitropyrimidin-2-yl)benzamide

Database identifiers

PubChem CID
57447263

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
101 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
2
Heavy atoms
20

Related reactions

4 records
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Compound notes

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