CID 3065280

Imidazo(2,1-b)quinazolin-5(1h)-one, 3-(p-chlorophenyl)-1-m-tolyl-

Structural Information

Molecular Formula
C23H16ClN3O
SMILES
CC1=CC(=CC=C1)N2C=C(N3C2=NC4=CC=CC=C4C3=O)C5=CC=C(C=C5)Cl
InChI
InChI=1S/C23H16ClN3O/c1-15-5-4-6-18(13-15)26-14-21(16-9-11-17(24)12-10-16)27-22(28)19-7-2-3-8-20(19)25-23(26)27/h2-14H,1H3
InChIKey
URLXPINBWDSMFS-UHFFFAOYSA-N
Compound name
3-(4-chlorophenyl)-1-(3-methylphenyl)imidazo[2,1-b]quinazolin-5-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

385.09818 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 386.10546 194.3
[M+Na]+ 408.08740 207.9
[M-H]- 384.09090 202.9
[M+NH4]+ 403.13200 206.4
[M+K]+ 424.06134 198.0
[M+H-H2O]+ 368.09544 182.5
[M+HCOO]- 430.09638 209.4
[M+CH3COO]- 444.11203 205.0
[M+Na-2H]- 406.07285 197.9
[M]+ 385.09763 199.8
[M]- 385.09873 199.8
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.