CID 63403

4(1h)-quinazolinone, 2,3-dihydro-1-(morpholinoacetyl)-3-(p-tolyl)-, hydrochloride

Structural Information

Molecular Formula
C21H23N3O3
SMILES
CC1=CC=C(C=C1)N2CN(C3=CC=CC=C3C2=O)C(=O)CN4CCOCC4
InChI
InChI=1S/C21H23N3O3/c1-16-6-8-17(9-7-16)23-15-24(19-5-3-2-4-18(19)21(23)26)20(25)14-22-10-12-27-13-11-22/h2-9H,10-15H2,1H3
InChIKey
ARMVEDJKGIBKOM-UHFFFAOYSA-N
Compound name
3-(4-methylphenyl)-1-(2-morpholin-4-ylacetyl)-2H-quinazolin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

365.17395 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 366.18123 189.2
[M+Na]+ 388.16317 203.5
[M+NH4]+ 383.20777 195.8
[M+K]+ 404.13711 196.2
[M-H]- 364.16667 195.0
[M+Na-2H]- 386.14862 195.3
[M]+ 365.17340 192.8
[M]- 365.17450 192.8
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.