CID 3049510

Sld-182

Structural Information

Molecular Formula
C21H25N5O4
SMILES
CN(C1CCN(CC1)C2=NC3=CC(=C(C=C3C(=N2)N)OC)OC)C(=O)C4=CC=CO4
InChI
InChI=1S/C21H25N5O4/c1-25(20(27)16-5-4-10-30-16)13-6-8-26(9-7-13)21-23-15-12-18(29-3)17(28-2)11-14(15)19(22)24-21/h4-5,10-13H,6-9H2,1-3H3,(H2,22,23,24)
InChIKey
MNJZCGJMBPRHBE-UHFFFAOYSA-N
Compound name
N-[1-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperidin-4-yl]-N-methylfuran-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

411.19064 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 412.19792 197.7
[M+Na]+ 434.17986 209.8
[M+NH4]+ 429.22446 202.8
[M+K]+ 450.15380 206.9
[M-H]- 410.18336 203.7
[M+Na-2H]- 432.16531 203.2
[M]+ 411.19009 200.8
[M]- 411.19119 200.8
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.