CID 123942

Senazodan

Structural Information

Molecular Formula
C15H14N4O
SMILES
C1CC(=O)NN=C1C2=CC=C(C=C2)NC3=CC=NC=C3
InChI
InChI=1S/C15H14N4O/c20-15-6-5-14(18-19-15)11-1-3-12(4-2-11)17-13-7-9-16-10-8-13/h1-4,7-10H,5-6H2,(H,16,17)(H,19,20)
InChIKey
XEBRQQXYWHMEQW-UHFFFAOYSA-N
Compound name
3-[4-(pyridin-4-ylamino)phenyl]-4,5-dihydro-1H-pyridazin-6-one
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

69
References

429
Patents

266.11676 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.12404 162.1
[M+Na]+ 289.10598 176.7
[M+NH4]+ 284.15058 169.3
[M+K]+ 305.07992 169.0
[M-H]- 265.10948 167.1
[M+Na-2H]- 287.09143 172.5
[M]+ 266.11621 165.5
[M]- 266.11731 165.5
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