CID 11517980

Azd2932

Structural Information

Molecular Formula
C24H25N5O4
SMILES
CC(C)N1C=C(C=N1)NC(=O)CC2=CC=C(C=C2)OC3=NC=NC4=CC(=C(C=C43)OC)OC
InChI
InChI=1S/C24H25N5O4/c1-15(2)29-13-17(12-27-29)28-23(30)9-16-5-7-18(8-6-16)33-24-19-10-21(31-3)22(32-4)11-20(19)25-14-26-24/h5-8,10-15H,9H2,1-4H3,(H,28,30)
InChIKey
TWYCZJMOEMMCGC-UHFFFAOYSA-N
Compound name
2-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]-N-(1-propan-2-ylpyrazol-4-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

9
References

322
Patents

447.19064 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 448.19792 208.1
[M+Na]+ 470.17986 215.8
[M-H]- 446.18336 214.6
[M+NH4]+ 465.22446 213.7
[M+K]+ 486.15380 210.9
[M+H-H2O]+ 430.18790 195.5
[M+HCOO]- 492.18884 226.4
[M+CH3COO]- 506.20449 235.1
[M+Na-2H]- 468.16531 209.6
[M]+ 447.19009 215.3
[M]- 447.19119 215.3
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