CID 3065279

Imidazo(2,1-b)quinazolin-5(1h)-one, 3-(4-chlorophenyl)-1-(3-hydroxyphenyl)-

Structural Information

Molecular Formula
C22H14ClN3O2
SMILES
C1=CC=C2C(=C1)C(=O)N3C(=CN(C3=N2)C4=CC(=CC=C4)O)C5=CC=C(C=C5)Cl
InChI
InChI=1S/C22H14ClN3O2/c23-15-10-8-14(9-11-15)20-13-25(16-4-3-5-17(27)12-16)22-24-19-7-2-1-6-18(19)21(28)26(20)22/h1-13,27H
InChIKey
KZHNPGDDKIYKTH-UHFFFAOYSA-N
Compound name
3-(4-chlorophenyl)-1-(3-hydroxyphenyl)imidazo[2,1-b]quinazolin-5-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

387.07745 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 388.08473 191.8
[M+Na]+ 410.06667 205.1
[M-H]- 386.07017 199.4
[M+NH4]+ 405.11127 203.1
[M+K]+ 426.04061 195.6
[M+H-H2O]+ 370.07471 180.7
[M+HCOO]- 432.07565 206.1
[M+CH3COO]- 446.09130 202.2
[M+Na-2H]- 408.05212 195.9
[M]+ 387.07690 196.7
[M]- 387.07800 196.7
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.