CID 3054857

1-propanesulfonanilide, 3'-methoxy-4'-(4-methoxy-9-acridinylamino)-, hydrochloride

Structural Information

Molecular Formula
C24H25N3O4S
SMILES
CCCS(=O)(=O)NC1=CC(=C(C=C1)NC2=C3C=CC=C(C3=NC4=CC=CC=C42)OC)OC
InChI
InChI=1S/C24H25N3O4S/c1-4-14-32(28,29)27-16-12-13-20(22(15-16)31-3)26-23-17-8-5-6-10-19(17)25-24-18(23)9-7-11-21(24)30-2/h5-13,15,27H,4,14H2,1-3H3,(H,25,26)
InChIKey
JRNNJSKMFMLEBQ-UHFFFAOYSA-N
Compound name
N-[3-methoxy-4-[(4-methoxyacridin-9-yl)amino]phenyl]propane-1-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

451.1566 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 452.16388 206.7
[M+Na]+ 474.14582 221.5
[M+NH4]+ 469.19042 213.4
[M+K]+ 490.11976 211.2
[M-H]- 450.14932 212.0
[M+Na-2H]- 472.13127 214.9
[M]+ 451.15605 210.9
[M]- 451.15715 210.9
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.