CID 5289179

[2-amino-6-(2,6-difluoro-benzoyl)-imidazo[1,2-a]pyridin-3-yl]-phenyl-methanone

Structural Information

Molecular Formula
C21H13F2N3O2
SMILES
C1=CC=C(C=C1)C(=O)C2=C(N=C3N2C=C(C=C3)C(=O)C4=C(C=CC=C4F)F)N
InChI
InChI=1S/C21H13F2N3O2/c22-14-7-4-8-15(23)17(14)19(27)13-9-10-16-25-21(24)18(26(16)11-13)20(28)12-5-2-1-3-6-12/h1-11H,24H2
InChIKey
WUGJIPFLBOATGL-UHFFFAOYSA-N
Compound name
[2-amino-6-(2,6-difluorobenzoyl)imidazo[1,2-a]pyridin-3-yl]-phenylmethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

22
Patents

377.0976 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 378.10488 187.0
[M+Na]+ 400.08682 197.4
[M-H]- 376.09032 193.5
[M+NH4]+ 395.13142 198.1
[M+K]+ 416.06076 190.0
[M+H-H2O]+ 360.09486 175.1
[M+HCOO]- 422.09580 206.4
[M+CH3COO]- 436.11145 197.1
[M+Na-2H]- 398.07227 187.4
[M]+ 377.09705 186.4
[M]- 377.09815 186.4
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

patents stripe