CID 3069715

Piperidine, 1-((2-((2-methylphenoxy)methyl)-4-oxo-3(4h)-quinazolinyl)acetyl)-

Structural Information

Molecular Formula
C23H25N3O3
SMILES
CC1=CC=CC=C1OCC2=NC3=CC=CC=C3C(=O)N2CC(=O)N4CCCCC4
InChI
InChI=1S/C23H25N3O3/c1-17-9-3-6-12-20(17)29-16-21-24-19-11-5-4-10-18(19)23(28)26(21)15-22(27)25-13-7-2-8-14-25/h3-6,9-12H,2,7-8,13-16H2,1H3
InChIKey
FJULCEKXUHSJMP-UHFFFAOYSA-N
Compound name
2-[(2-methylphenoxy)methyl]-3-(2-oxo-2-piperidin-1-ylethyl)quinazolin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

391.1896 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 392.19688 195.9
[M+Na]+ 414.17882 211.1
[M+NH4]+ 409.22342 202.3
[M+K]+ 430.15276 202.7
[M-H]- 390.18232 200.7
[M+Na-2H]- 412.16427 203.8
[M]+ 391.18905 199.4
[M]- 391.19015 199.4
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.