CID 149570

Brn 0467172

Structural Information

Molecular Formula
C25H26N4O5S
SMILES
COC1=C(C=CC(=C1)NS(=O)(=O)C)NC2=C3C=CC=C(C3=NC4=CC=CC=C42)OCCCC(=O)N
InChI
InChI=1S/C25H26N4O5S/c1-33-22-15-16(29-35(2,31)32)12-13-20(22)28-24-17-7-3-4-9-19(17)27-25-18(24)8-5-10-21(25)34-14-6-11-23(26)30/h3-5,7-10,12-13,15,29H,6,11,14H2,1-2H3,(H2,26,30)(H,27,28)
InChIKey
CEWLBXFJVVETBI-UHFFFAOYSA-N
Compound name
4-[9-[4-(methanesulfonamido)-2-methoxyanilino]acridin-4-yl]oxybutanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

494.16238 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 495.16966 214.6
[M+Na]+ 517.15160 226.7
[M+NH4]+ 512.19620 219.5
[M+K]+ 533.12554 218.3
[M-H]- 493.15510 219.0
[M+Na-2H]- 515.13705 221.3
[M]+ 494.16183 217.9
[M]- 494.16293 217.9
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.