CID 660311

5-[3-(4-fluorophenyl)-1-phenyl-1h-pyrazol-4-yl]-2,4-imidazolidinedione

Structural Information

Molecular Formula
C18H13FN4O2
SMILES
C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)F)C4C(=O)NC(=O)N4
InChI
InChI=1S/C18H13FN4O2/c19-12-8-6-11(7-9-12)15-14(16-17(24)21-18(25)20-16)10-23(22-15)13-4-2-1-3-5-13/h1-10,16H,(H2,20,21,24,25)
InChIKey
MPQWYPLPWGUMJE-UHFFFAOYSA-N
Compound name
5-[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]imidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

14
References

23
Patents

336.10226 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 337.10954 176.6
[M+Na]+ 359.09148 185.7
[M-H]- 335.09498 181.7
[M+NH4]+ 354.13608 186.5
[M+K]+ 375.06542 177.7
[M+H-H2O]+ 319.09952 165.3
[M+HCOO]- 381.10046 192.3
[M+CH3COO]- 395.11611 185.9
[M+Na-2H]- 357.07693 174.1
[M]+ 336.10171 171.7
[M]- 336.10281 171.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.