CID 3072321

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

Structural Information

Molecular Formula
C18H14N4O
SMILES
C1CC1N2C=NC3=C2C(=O)N(C4=C3C=CC=N4)C5=CC=CC=C5
InChI
InChI=1S/C18H14N4O/c23-18-16-15(20-11-21(16)12-8-9-12)14-7-4-10-19-17(14)22(18)13-5-2-1-3-6-13/h1-7,10-12H,8-9H2
InChIKey
QBPFSQUYMVNLRM-UHFFFAOYSA-N
Compound name
3-cyclopropyl-5-phenylimidazo[4,5-c][1,8]naphthyridin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

302.11676 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 303.12404 182.1
[M+Na]+ 325.10598 196.0
[M-H]- 301.10948 189.3
[M+NH4]+ 320.15058 190.7
[M+K]+ 341.07992 187.0
[M+H-H2O]+ 285.11402 171.4
[M+HCOO]- 347.11496 201.7
[M+CH3COO]- 361.13061 192.7
[M+Na-2H]- 323.09143 187.2
[M]+ 302.11621 186.3
[M]- 302.11731 186.3
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.