CID 3065285

Imidazo(2,1-b)quinazolin-5(1h)-one, 3-(4-bromophenyl)-1-(4-methoxyphenyl)-

Structural Information

Molecular Formula
C23H16BrN3O2
SMILES
COC1=CC=C(C=C1)N2C=C(N3C2=NC4=CC=CC=C4C3=O)C5=CC=C(C=C5)Br
InChI
InChI=1S/C23H16BrN3O2/c1-29-18-12-10-17(11-13-18)26-14-21(15-6-8-16(24)9-7-15)27-22(28)19-4-2-3-5-20(19)25-23(26)27/h2-14H,1H3
InChIKey
HUTLGENRQOZEJX-UHFFFAOYSA-N
Compound name
3-(4-bromophenyl)-1-(4-methoxyphenyl)imidazo[2,1-b]quinazolin-5-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

445.0426 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 446.04988 199.9
[M+Na]+ 468.03182 209.4
[M+NH4]+ 463.07642 204.5
[M+K]+ 484.00576 206.9
[M-H]- 444.03532 204.4
[M+Na-2H]- 466.01727 206.1
[M]+ 445.04205 201.8
[M]- 445.04315 201.8
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.