CID 508450

Chembl491013

Structural Information

Molecular Formula
C23H20ClN3
SMILES
C1=CC=C(C=C1)C2=CC=C(C=C2)CN(CC3=CC=C(C=C3)Cl)N4C=CN=C4
InChI
InChI=1S/C23H20ClN3/c24-23-12-8-20(9-13-23)17-27(26-15-14-25-18-26)16-19-6-10-22(11-7-19)21-4-2-1-3-5-21/h1-15,18H,16-17H2
InChIKey
AQTHISXTNMUQFG-UHFFFAOYSA-N
Compound name
N-[(4-chlorophenyl)methyl]-N-[(4-phenylphenyl)methyl]imidazol-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

373.13458 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 374.14186 190.1
[M+Na]+ 396.12380 197.0
[M-H]- 372.12730 200.7
[M+NH4]+ 391.16840 201.2
[M+K]+ 412.09774 189.1
[M+H-H2O]+ 356.13184 177.8
[M+HCOO]- 418.13278 208.6
[M+CH3COO]- 432.14843 199.9
[M+Na-2H]- 394.10925 192.8
[M]+ 373.13403 192.2
[M]- 373.13513 192.2
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.