CID 3071973

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

Structural Information

Molecular Formula
C23H18N4O
SMILES
C1=CC=C(C=C1)CCN2C=NC3=C2C(=O)N(C4=C3C=CC=N4)C5=CC=CC=C5
InChI
InChI=1S/C23H18N4O/c28-23-21-20(25-16-26(21)15-13-17-8-3-1-4-9-17)19-12-7-14-24-22(19)27(23)18-10-5-2-6-11-18/h1-12,14,16H,13,15H2
InChIKey
IXLSNKLSZXXUQX-UHFFFAOYSA-N
Compound name
5-phenyl-3-(2-phenylethyl)imidazo[4,5-c][1,8]naphthyridin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

6
Patents

366.14807 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 367.155346 190.2
[M+Na]+ 389.137288 201.2
[M-H]- 365.140794 197.0
[M+NH4]+ 384.181893 200.2
[M+K]+ 405.111228 192.0
[M+H-H2O]+ 349.145330 177.3
[M+HCOO]- 411.146271 208.6
[M+CH3COO]- 425.161921 199.9
[M+Na-2H]- 387.122736 195.9
[M]+ 366.14752142 192.8
[M]- 366.14861858 192.8
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