CID 516026

2-methyl-5-propyl-7-(4-pyridyl)pyrazolo[4,3-c]quinolin-3-one

Structural Information

Molecular Formula
C19H18N4O
SMILES
CCCN1C=C2C(=NN(C2=O)C)C3=C1C=C(C=C3)C4=CC=NC=C4
InChI
InChI=1S/C19H18N4O/c1-3-10-23-12-16-18(21-22(2)19(16)24)15-5-4-14(11-17(15)23)13-6-8-20-9-7-13/h4-9,11-12H,3,10H2,1-2H3
InChIKey
JKOIDRRSNJCJNE-UHFFFAOYSA-N
Compound name
2-methyl-5-propyl-7-pyridin-4-ylpyrazolo[4,3-c]quinolin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

318.14807 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 319.15535 178.6
[M+Na]+ 341.13729 191.3
[M-H]- 317.14079 183.0
[M+NH4]+ 336.18189 191.8
[M+K]+ 357.11123 183.6
[M+H-H2O]+ 301.14533 167.7
[M+HCOO]- 363.14627 197.5
[M+CH3COO]- 377.16192 189.8
[M+Na-2H]- 339.12274 183.6
[M]+ 318.14752 183.4
[M]- 318.14862 183.4
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

No patent data available for this compound.