CID 63405

4(1h)-quinazolinone, 2,3-dihydro-3-(m-chlorophenyl)-1-(morpholinoacetyl)-, hydrochloride

Structural Information

Molecular Formula
C20H20ClN3O3
SMILES
C1COCCN1CC(=O)N2CN(C(=O)C3=CC=CC=C32)C4=CC(=CC=C4)Cl
InChI
InChI=1S/C20H20ClN3O3/c21-15-4-3-5-16(12-15)23-14-24(18-7-2-1-6-17(18)20(23)26)19(25)13-22-8-10-27-11-9-22/h1-7,12H,8-11,13-14H2
InChIKey
WKYBRDRXUXGJCA-UHFFFAOYSA-N
Compound name
3-(3-chlorophenyl)-1-(2-morpholin-4-ylacetyl)-2H-quinazolin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

385.11932 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 386.12660 190.3
[M+Na]+ 408.10854 205.6
[M+NH4]+ 403.15314 197.3
[M+K]+ 424.08248 197.6
[M-H]- 384.11204 196.2
[M+Na-2H]- 406.09399 196.7
[M]+ 385.11877 194.4
[M]- 385.11987 194.4
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.