CID 501363

2,4-difluoro-n-(1h-indazol-5-yl)-5-(2-methyl-4,5-dihydroimidazol-1-yl)benzamide

Structural Information

Molecular Formula
C18H15F2N5O
SMILES
CC1=NCCN1C2=C(C=C(C(=C2)C(=O)NC3=CC4=C(C=C3)NN=C4)F)F
InChI
InChI=1S/C18H15F2N5O/c1-10-21-4-5-25(10)17-7-13(14(19)8-15(17)20)18(26)23-12-2-3-16-11(6-12)9-22-24-16/h2-3,6-9H,4-5H2,1H3,(H,22,24)(H,23,26)
InChIKey
VPNZYPAWJPEUFQ-UHFFFAOYSA-N
Compound name
2,4-difluoro-N-(1H-indazol-5-yl)-5-(2-methyl-4,5-dihydroimidazol-1-yl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

355.12448 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 356.13176 179.7
[M+Na]+ 378.11370 190.2
[M-H]- 354.11720 183.3
[M+NH4]+ 373.15830 191.0
[M+K]+ 394.08764 182.5
[M+H-H2O]+ 338.12174 168.0
[M+HCOO]- 400.12268 197.0
[M+CH3COO]- 414.13833 189.4
[M+Na-2H]- 376.09915 179.5
[M]+ 355.12393 178.0
[M]- 355.12503 178.0
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.