CID 132398697

1-[(3-chlorophenyl)methyl]-3-[4-(1h-pyrazol-4-yl)phenyl]imidazolidin-2-one

Structural Information

Molecular Formula
C19H17ClN4O
SMILES
C1CN(C(=O)N1CC2=CC(=CC=C2)Cl)C3=CC=C(C=C3)C4=CNN=C4
InChI
InChI=1S/C19H17ClN4O/c20-17-3-1-2-14(10-17)13-23-8-9-24(19(23)25)18-6-4-15(5-7-18)16-11-21-22-12-16/h1-7,10-12H,8-9,13H2,(H,21,22)
InChIKey
MBMZNISWCQSMJO-UHFFFAOYSA-N
Compound name
1-[(3-chlorophenyl)methyl]-3-[4-(1H-pyrazol-4-yl)phenyl]imidazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

352.1091 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 353.116376 183.2
[M+Na]+ 375.098318 191.8
[M-H]- 351.101824 189.7
[M+NH4]+ 370.142923 193.8
[M+K]+ 391.072258 183.5
[M+H-H2O]+ 335.106360 171.5
[M+HCOO]- 397.107301 195.8
[M+CH3COO]- 411.122951 192.4
[M+Na-2H]- 373.083766 180.9
[M]+ 352.10855142 182.0
[M]- 352.10964858 182.0
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.