CID 6410708

Pyridazine, 4,6-diphenyl-3-(4-phenyl-1-piperazinyl)-

Structural Information

Molecular Formula
C26H24N4
SMILES
C1CN(CCN1C2=CC=CC=C2)C3=NN=C(C=C3C4=CC=CC=C4)C5=CC=CC=C5
InChI
InChI=1S/C26H24N4/c1-4-10-21(11-5-1)24-20-25(22-12-6-2-7-13-22)27-28-26(24)30-18-16-29(17-19-30)23-14-8-3-9-15-23/h1-15,20H,16-19H2
InChIKey
FIAYRUPHXMMPMI-UHFFFAOYSA-N
Compound name
4,6-diphenyl-3-(4-phenylpiperazin-1-yl)pyridazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

26
Patents

392.2001 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 393.20738 199.9
[M+Na]+ 415.18932 204.4
[M-H]- 391.19282 208.0
[M+NH4]+ 410.23392 203.3
[M+K]+ 431.16326 194.7
[M+H-H2O]+ 375.19736 183.8
[M+HCOO]- 437.19830 213.1
[M+CH3COO]- 451.21395 206.0
[M+Na-2H]- 413.17477 203.1
[M]+ 392.19955 192.8
[M]- 392.20065 192.8
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

patents stripe