CID 178135

Altapizone

Structural Information

Molecular Formula
C24H28N4O2
SMILES
C1CN(CCC1C2=CC=CC=C2)CCC(=O)NC3=CC=C(C=C3)C4=NNC(=O)CC4
InChI
InChI=1S/C24H28N4O2/c29-23(14-17-28-15-12-19(13-16-28)18-4-2-1-3-5-18)25-21-8-6-20(7-9-21)22-10-11-24(30)27-26-22/h1-9,19H,10-17H2,(H,25,29)(H,27,30)
InChIKey
JQUDBRIUEIAJNQ-UHFFFAOYSA-N
Compound name
N-[4-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]-3-(4-phenylpiperidin-1-yl)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

27
Patents

404.22122 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 405.228496 199.6
[M+Na]+ 427.210438 200.6
[M-H]- 403.213944 204.6
[M+NH4]+ 422.255043 203.4
[M+K]+ 443.184378 193.1
[M+H-H2O]+ 387.218480 186.1
[M+HCOO]- 449.219421 210.9
[M+CH3COO]- 463.235071 204.6
[M+Na-2H]- 425.195886 199.4
[M]+ 404.22067142 190.3
[M]- 404.22176858 190.3
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.