CID 64083

4(1h)-quinazolinone, 2,3-dihydro-1-(3-morpholinopropionyl)-3-phenyl-, hydrochloride

Structural Information

Molecular Formula
C21H23N3O3
SMILES
C1COCCN1CCC(=O)N2CN(C(=O)C3=CC=CC=C32)C4=CC=CC=C4
InChI
InChI=1S/C21H23N3O3/c25-20(10-11-22-12-14-27-15-13-22)24-16-23(17-6-2-1-3-7-17)21(26)18-8-4-5-9-19(18)24/h1-9H,10-16H2
InChIKey
LSKNWTXHAYPYAZ-UHFFFAOYSA-N
Compound name
1-(3-morpholin-4-ylpropanoyl)-3-phenyl-2H-quinazolin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

365.17395 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 366.18123 189.6
[M+Na]+ 388.16317 193.3
[M-H]- 364.16667 194.7
[M+NH4]+ 383.20777 196.0
[M+K]+ 404.13711 188.8
[M+H-H2O]+ 348.17121 176.7
[M+HCOO]- 410.17215 200.0
[M+CH3COO]- 424.18780 196.6
[M+Na-2H]- 386.14862 191.2
[M]+ 365.17340 184.9
[M]- 365.17450 184.9
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.