CID 44542366

2-(4-(pyridin-2-yl)phenyl)-1h-benzo(d)imidazole-4-carboxamide

Structural Information

Molecular Formula
C19H14N4O
SMILES
C1=CC=NC(=C1)C2=CC=C(C=C2)C3=NC4=C(C=CC=C4N3)C(=O)N
InChI
InChI=1S/C19H14N4O/c20-18(24)14-4-3-6-16-17(14)23-19(22-16)13-9-7-12(8-10-13)15-5-1-2-11-21-15/h1-11H,(H2,20,24)(H,22,23)
InChIKey
GTBYWKYWQWSPTR-UHFFFAOYSA-N
Compound name
2-(4-pyridin-2-ylphenyl)-1H-benzimidazole-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

314.11676 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 315.12404 172.5
[M+Na]+ 337.10598 181.8
[M-H]- 313.10948 178.5
[M+NH4]+ 332.15058 184.0
[M+K]+ 353.07992 174.0
[M+H-H2O]+ 297.11402 162.1
[M+HCOO]- 359.11496 192.7
[M+CH3COO]- 373.13061 183.0
[M+Na-2H]- 335.09143 177.5
[M]+ 314.11621 171.1
[M]- 314.11731 171.1
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.