CID 3021914

5,5-diphenyl-3-(2-(4-(2-hydroxypropyl)-1-piperazinyl)-2-oxoethyl)hydantoin hydrochloride

Structural Information

Molecular Formula
C24H28N4O4
SMILES
CC(CN1CCN(CC1)C(=O)CN2C(=O)C(NC2=O)(C3=CC=CC=C3)C4=CC=CC=C4)O
InChI
InChI=1S/C24H28N4O4/c1-18(29)16-26-12-14-27(15-13-26)21(30)17-28-22(31)24(25-23(28)32,19-8-4-2-5-9-19)20-10-6-3-7-11-20/h2-11,18,29H,12-17H2,1H3,(H,25,32)
InChIKey
DGQRZLKOGKIMFI-UHFFFAOYSA-N
Compound name
3-[2-[4-(2-hydroxypropyl)piperazin-1-yl]-2-oxoethyl]-5,5-diphenylimidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

436.21106 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 437.21834 205.7
[M+Na]+ 459.20028 208.5
[M-H]- 435.20378 209.6
[M+NH4]+ 454.24488 210.5
[M+K]+ 475.17422 202.4
[M+H-H2O]+ 419.20832 193.7
[M+HCOO]- 481.20926 213.7
[M+CH3COO]- 495.22491 223.3
[M+Na-2H]- 457.18573 201.1
[M]+ 436.21051 199.2
[M]- 436.21161 199.2
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.