3-[1-(3-fluorophenyl)-1H-pyrazol-5-yl]-1-[3-(trifluoromethyl)phenyl]pyridazin-4(1H)-one

HCID 59436232
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Basic information

Standard SMILES
O=c1ccn(-c2cccc(C(F)(F)F)c2)nc1-c1ccnn1-c1cccc(F)c1
InChIKey
LHIGYZSGLPSCQL-UHFFFAOYSA-N
Molecular formula
C20H12F4N4O
Average molar mass
400.3 g/mol
Monoisotopic mass
400.09472367

Names & identifiers

Preferred name
3-[1-(3-fluorophenyl)-1H-pyrazol-5-yl]-1-[3-(trifluoromethyl)phenyl]pyridazin-4(1H)-one
IUPAC
3-[2-(3-fluorophenyl)pyrazol-3-yl]-1-[3-(trifluoromethyl)phenyl]pyridazin-4-one

Names & synonyms

3-[1-(3-fluorophenyl)-1H-pyrazol-5-yl]-1-[3-(trifluoromethyl)phenyl]pyridazin-4(1H)-oneSCHEMBL519269

Database identifiers

PubChem CID
59436232

Properties

Computed structural properties

XLogP
4.5
Topological polar surface area
50.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
8
Rotatable bonds
3
Heavy atoms
29

Related reactions

5 records
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Compound notes

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