CID 23581869

Azd-7325

Structural Information

Molecular Formula
C19H19FN4O2
SMILES
CCCNC(=O)C1=NN=C2C(=C1N)C=CC=C2C3=C(C=CC=C3F)OC
InChI
InChI=1S/C19H19FN4O2/c1-3-10-22-19(25)18-16(21)12-7-4-6-11(17(12)23-24-18)15-13(20)8-5-9-14(15)26-2/h4-9H,3,10H2,1-2H3,(H2,21,23)(H,22,25)
InChIKey
KYDURMHFWXCKMW-UHFFFAOYSA-N
Compound name
4-amino-8-(2-fluoro-6-methoxyphenyl)-N-propylcinnoline-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

14
References

108
Patents

354.1492 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 355.15648 184.1
[M+Na]+ 377.13842 197.1
[M+NH4]+ 372.18302 189.9
[M+K]+ 393.11236 190.0
[M-H]- 353.14192 187.1
[M+Na-2H]- 375.12387 190.4
[M]+ 354.14865 186.6
[M]- 354.14975 186.6
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