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3-Fluoroacetamido-benzoylurea

HCID 398523
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Basic information

CAS
218935-76-3
Standard SMILES
NC(=O)NC(=O)c1cccc(NC(=O)CF)c1
InChIKey
CSMDLWPNYYCKAC-UHFFFAOYSA-N
Molecular formula
C10H10FN3O3
Average molar mass
239.2 g/mol
Monoisotopic mass
239.07061935

Names & identifiers

Preferred name
3-Fluoroacetamido-benzoylurea
IUPAC
N-carbamoyl-3-[(2-fluoroacetyl)amino]benzamide

Names & synonyms

3-Fluoroacetamido-benzoylureaNSC708438218935-76-3CHEMBL1999516DTXSID601216919NSC-708438NCI60_038403N-Carbamoyl-3-(2-fluoroacetamido)benzamideN-(Aminocarbonyl)-3-[(2-fluoroacetyl)amino]benzamide

Database identifiers

CAS
218935-76-3
PubChem CID
398523
DTXSID
DTXSID601216919
ChEMBL
CHEMBL1999516

Properties

Computed structural properties

XLogP
0.5
Topological polar surface area
101 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
17
Formal charge
0
Complexity
322

Related reactions

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Compound notes

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