CID 54684694

138304-90-2

Structural Information

Molecular Formula
C20H14N4O3
SMILES
C1=CC=C(C=C1)N2C3=C(C=CC=N3)C(=C(C2=O)C(=O)NC4=CN=CC=C4)O
InChI
InChI=1S/C20H14N4O3/c25-17-15-9-5-11-22-18(15)24(14-7-2-1-3-8-14)20(27)16(17)19(26)23-13-6-4-10-21-12-13/h1-12,25H,(H,23,26)
InChIKey
ATYCNZYEBOZRLM-UHFFFAOYSA-N
Compound name
4-hydroxy-2-oxo-1-phenyl-N-pyridin-3-yl-1,8-naphthyridine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

6
Patents

358.1066 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 359.11388 183.7
[M+Na]+ 381.09582 200.5
[M+NH4]+ 376.14042 189.9
[M+K]+ 397.06976 192.8
[M-H]- 357.09932 189.0
[M+Na-2H]- 379.08127 194.1
[M]+ 358.10605 187.6
[M]- 358.10715 187.6
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