CID 153622970

E3 ubiquitin ligase binder-1

Structural Information

Molecular Formula
C15H19N3O2
SMILES
C1CNCCC1C2=CC=C(C=C2)N3CCC(=O)NC3=O
InChI
InChI=1S/C15H19N3O2/c19-14-7-10-18(15(20)17-14)13-3-1-11(2-4-13)12-5-8-16-9-6-12/h1-4,12,16H,5-10H2,(H,17,19,20)
InChIKey
NFGNPHVMGPKQKF-UHFFFAOYSA-N
Compound name
1-(4-piperidin-4-ylphenyl)-1,3-diazinane-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

49
Patents

273.14774 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.15502 167.3
[M+Na]+ 296.13696 170.9
[M-H]- 272.14046 168.7
[M+NH4]+ 291.18156 177.0
[M+K]+ 312.11090 164.8
[M+H-H2O]+ 256.14500 156.8
[M+HCOO]- 318.14594 177.6
[M+CH3COO]- 332.16159 174.7
[M+Na-2H]- 294.12241 167.9
[M]+ 273.14719 155.9
[M]- 273.14829 155.9
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

patents stripe