CID 86270361

1628502-91-9

Structural Information

Molecular Formula
C24H23N5
SMILES
CN1CCN(CC1)C2=NN=C(C(=C2)C3=CC=NC=C3)C4=CC5=CC=CC=C5C=C4
InChI
InChI=1S/C24H23N5/c1-28-12-14-29(15-13-28)23-17-22(19-8-10-25-11-9-19)24(27-26-23)21-7-6-18-4-2-3-5-20(18)16-21/h2-11,16-17H,12-15H2,1H3
InChIKey
CIIVUDIZZJLXCN-UHFFFAOYSA-N
Compound name
6-(4-methylpiperazin-1-yl)-3-naphthalen-2-yl-4-pyridin-4-ylpyridazine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

8
References

31
Patents

381.19534 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 382.20262 197.2
[M+Na]+ 404.18456 216.3
[M+NH4]+ 399.22916 205.1
[M+K]+ 420.15850 205.3
[M-H]- 380.18806 205.0
[M+Na-2H]- 402.17001 209.3
[M]+ 381.19479 202.4
[M]- 381.19589 202.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe