CID 10451245

Chembl219515

Structural Information

Molecular Formula
C25H19N3
SMILES
C1=CC=C(C=C1)C2=CC=C(C=C2)CN3C=CC4=NC(=NC4=C3)C5=CC=CC=C5
InChI
InChI=1S/C25H19N3/c1-3-7-20(8-4-1)21-13-11-19(12-14-21)17-28-16-15-23-24(18-28)27-25(26-23)22-9-5-2-6-10-22/h1-16,18H,17H2
InChIKey
MMVUCDMKDSXBOC-UHFFFAOYSA-N
Compound name
2-phenyl-5-[(4-phenylphenyl)methyl]imidazo[4,5-c]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

25
Patents

361.1579 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 362.16518 189.3
[M+Na]+ 384.14712 197.5
[M-H]- 360.15062 198.6
[M+NH4]+ 379.19172 199.3
[M+K]+ 400.12106 188.3
[M+H-H2O]+ 344.15516 176.2
[M+HCOO]- 406.15610 208.3
[M+CH3COO]- 420.17175 198.7
[M+Na-2H]- 382.13257 193.4
[M]+ 361.15735 188.3
[M]- 361.15845 188.3
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