CID 152602

Brn 0444770

Structural Information

Molecular Formula
C20H17N3O2S
SMILES
C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NC4=CC=C(C=C4)CS(=O)(=O)N
InChI
InChI=1S/C20H17N3O2S/c21-26(24,25)13-14-9-11-15(12-10-14)22-20-16-5-1-3-7-18(16)23-19-8-4-2-6-17(19)20/h1-12H,13H2,(H,22,23)(H2,21,24,25)
InChIKey
QPLRHBSMCAJLGG-UHFFFAOYSA-N
Compound name
[4-(acridin-9-ylamino)phenyl]methanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

363.10416 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 364.11144 181.2
[M+Na]+ 386.09338 197.0
[M+NH4]+ 381.13798 189.8
[M+K]+ 402.06732 186.4
[M-H]- 362.09688 187.4
[M+Na-2H]- 384.07883 191.4
[M]+ 363.10361 185.9
[M]- 363.10471 185.9
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.