CID 3071977

4h-imidazo(4,5-c)(1,8)naphthyridin-4-one, 3,5-dihydro-3-(2-ethoxyethyl)-5-phenyl-

Structural Information

Molecular Formula
C19H18N4O2
SMILES
CCOCCN1C=NC2=C1C(=O)N(C3=C2C=CC=N3)C4=CC=CC=C4
InChI
InChI=1S/C19H18N4O2/c1-2-25-12-11-22-13-21-16-15-9-6-10-20-18(15)23(19(24)17(16)22)14-7-4-3-5-8-14/h3-10,13H,2,11-12H2,1H3
InChIKey
KBZIXAAXNOSVCP-UHFFFAOYSA-N
Compound name
3-(2-ethoxyethyl)-5-phenylimidazo[4,5-c][1,8]naphthyridin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

6
Patents

334.14297 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 335.15025 180.4
[M+Na]+ 357.13219 191.9
[M-H]- 333.13569 184.4
[M+NH4]+ 352.17679 192.5
[M+K]+ 373.10613 185.0
[M+H-H2O]+ 317.14023 169.1
[M+HCOO]- 379.14117 199.5
[M+CH3COO]- 393.15682 191.1
[M+Na-2H]- 355.11764 186.3
[M]+ 334.14242 186.1
[M]- 334.14352 186.1
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.