CID 5330608

Phenylaminoimidazo(1,2-alpha)pyridine

Structural Information

Molecular Formula
C20H14Cl2N4O3S
SMILES
C1=CC(=C(C(=C1)Cl)C(=O)C2=CN3C=C(N=C3C=C2)NC4=CC=C(C=C4)S(=O)(=O)N)Cl
InChI
InChI=1S/C20H14Cl2N4O3S/c21-15-2-1-3-16(22)19(15)20(27)12-4-9-18-25-17(11-26(18)10-12)24-13-5-7-14(8-6-13)30(23,28)29/h1-11,24H,(H2,23,28,29)
InChIKey
UQAWGIKJINAKIZ-UHFFFAOYSA-N
Compound name
4-[[6-(2,6-dichlorobenzoyl)imidazo[1,2-a]pyridin-2-yl]amino]benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

7
Patents

460.01636 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 461.02364 203.6
[M+Na]+ 483.00558 215.1
[M-H]- 459.00908 212.4
[M+NH4]+ 478.05018 213.5
[M+K]+ 498.97952 207.1
[M+H-H2O]+ 443.01362 195.9
[M+HCOO]- 505.01456 211.9
[M+CH3COO]- 519.03021 213.0
[M+Na-2H]- 480.99103 205.9
[M]+ 460.01581 211.0
[M]- 460.01691 211.0
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