CID 88959

21598-58-3

Structural Information

Molecular Formula
C21H24N4O2
SMILES
CN1CCN(CC1)CN2C(=O)C(NC2=O)(C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C21H24N4O2/c1-23-12-14-24(15-13-23)16-25-19(26)21(22-20(25)27,17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-11H,12-16H2,1H3,(H,22,27)
InChIKey
KNVIWKFOCCEBOC-UHFFFAOYSA-N
Compound name
3-[(4-methylpiperazin-1-yl)methyl]-5,5-diphenylimidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

364.1899 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 365.19718 190.4
[M+Na]+ 387.17912 195.8
[M-H]- 363.18262 195.7
[M+NH4]+ 382.22372 199.3
[M+K]+ 403.15306 188.8
[M+H-H2O]+ 347.18716 177.7
[M+HCOO]- 409.18810 202.3
[M+CH3COO]- 423.20375 197.6
[M+Na-2H]- 385.16457 188.9
[M]+ 364.18935 183.6
[M]- 364.19045 183.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.