CID 510041

Chembl489359

Structural Information

Molecular Formula
C24H20Cl2N2
SMILES
C1=CC=C(C=C1)C2=CC=C(C=C2)CC(CC3=C(C=C(C=C3)Cl)Cl)N4C=CN=C4
InChI
InChI=1S/C24H20Cl2N2/c25-22-11-10-21(24(26)16-22)15-23(28-13-12-27-17-28)14-18-6-8-20(9-7-18)19-4-2-1-3-5-19/h1-13,16-17,23H,14-15H2
InChIKey
NVQBYKHOPUTNFK-UHFFFAOYSA-N
Compound name
1-[1-(2,4-dichlorophenyl)-3-(4-phenylphenyl)propan-2-yl]imidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

406.10034 Da
Monoisotopic Mass

6.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 407.10762 197.7
[M+Na]+ 429.08956 205.8
[M-H]- 405.09306 206.1
[M+NH4]+ 424.13416 207.9
[M+K]+ 445.06350 196.1
[M+H-H2O]+ 389.09760 185.9
[M+HCOO]- 451.09854 208.0
[M+CH3COO]- 465.11419 206.4
[M+Na-2H]- 427.07501 197.1
[M]+ 406.09979 200.7
[M]- 406.10089 200.7
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.