CID 3021918

Hydantoin, 3-(2-(4-benzyl-1-piperazinyl)-2-oxoethyl)-5,5-diphenyl-, hydrochloride

Structural Information

Molecular Formula
C28H28N4O3
SMILES
C1CN(CCN1CC2=CC=CC=C2)C(=O)CN3C(=O)C(NC3=O)(C4=CC=CC=C4)C5=CC=CC=C5
InChI
InChI=1S/C28H28N4O3/c33-25(31-18-16-30(17-19-31)20-22-10-4-1-5-11-22)21-32-26(34)28(29-27(32)35,23-12-6-2-7-13-23)24-14-8-3-9-15-24/h1-15H,16-21H2,(H,29,35)
InChIKey
BPUFZZRGWQCEKR-UHFFFAOYSA-N
Compound name
3-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-5,5-diphenylimidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

468.21616 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 469.22344 215.4
[M+Na]+ 491.20538 228.9
[M+NH4]+ 486.24998 221.5
[M+K]+ 507.17932 220.9
[M-H]- 467.20888 221.5
[M+Na-2H]- 489.19083 225.4
[M]+ 468.21561 219.0
[M]- 468.21671 219.0
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.