CID 364446

Azacridomide

Structural Information

Molecular Formula
C19H14N4O4S
SMILES
C1=CC=C2C(=C1)C(=O)N3C=CC=C(C3=N2)C(=O)NC4=CC=C(C=C4)S(=O)(=O)N
InChI
InChI=1S/C19H14N4O4S/c20-28(26,27)13-9-7-12(8-10-13)21-18(24)15-5-3-11-23-17(15)22-16-6-2-1-4-14(16)19(23)25/h1-11H,(H,21,24)(H2,20,26,27)
InChIKey
AHGBBGZQXYSBCC-UHFFFAOYSA-N
Compound name
11-oxo-N-(4-sulfamoylphenyl)pyrido[2,1-b]quinazoline-6-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

394.07358 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 395.08086 188.4
[M+Na]+ 417.06280 198.5
[M-H]- 393.06630 194.5
[M+NH4]+ 412.10740 198.1
[M+K]+ 433.03674 192.2
[M+H-H2O]+ 377.07084 179.0
[M+HCOO]- 439.07178 204.2
[M+CH3COO]- 453.08743 198.1
[M+Na-2H]- 415.04825 197.0
[M]+ 394.07303 192.1
[M]- 394.07413 192.1
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.