CID 211527

23338-39-8

Structural Information

Molecular Formula
C24H28N4O2
SMILES
CN(C)C1=CC=C(C=C1)C2=CC(=NN(C2=O)CCN3CCOCC3)C4=CC=CC=C4
InChI
InChI=1S/C24H28N4O2/c1-26(2)21-10-8-19(9-11-21)22-18-23(20-6-4-3-5-7-20)25-28(24(22)29)13-12-27-14-16-30-17-15-27/h3-11,18H,12-17H2,1-2H3
InChIKey
FHAXTAMJLHIAMQ-UHFFFAOYSA-N
Compound name
4-[4-(dimethylamino)phenyl]-2-(2-morpholin-4-ylethyl)-6-phenylpyridazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

404.22122 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 405.22850 202.5
[M+Na]+ 427.21044 207.2
[M-H]- 403.21394 211.8
[M+NH4]+ 422.25504 206.8
[M+K]+ 443.18438 202.2
[M+H-H2O]+ 387.21848 188.1
[M+HCOO]- 449.21942 218.2
[M+CH3COO]- 463.23507 210.0
[M+Na-2H]- 425.19589 204.1
[M]+ 404.22067 201.1
[M]- 404.22177 201.1
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.