CID 3065290

Imidazo(2,1-b)quinazolin-5(1h)-one, 3-(p-bromophenyl)-1-(p-hydroxyphenyl)-

Structural Information

Molecular Formula
C22H14BrN3O2
SMILES
C1=CC=C2C(=C1)C(=O)N3C(=CN(C3=N2)C4=CC=C(C=C4)O)C5=CC=C(C=C5)Br
InChI
InChI=1S/C22H14BrN3O2/c23-15-7-5-14(6-8-15)20-13-25(16-9-11-17(27)12-10-16)22-24-19-4-2-1-3-18(19)21(28)26(20)22/h1-13,27H
InChIKey
LSSMWWZSXBATLL-UHFFFAOYSA-N
Compound name
3-(4-bromophenyl)-1-(4-hydroxyphenyl)imidazo[2,1-b]quinazolin-5-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

431.02695 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 432.03423 196.4
[M+Na]+ 454.01617 205.6
[M+NH4]+ 449.06077 200.9
[M+K]+ 469.99011 203.6
[M-H]- 430.01967 200.6
[M+Na-2H]- 452.00162 202.3
[M]+ 431.02640 198.1
[M]- 431.02750 198.1
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.