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]+ 395.080856 188.4
[M+Na]+ 417.062798 198.5
[M-H]- 393.066304 194.5
[M+NH4]+ 412.107403 198.1
[M+K]+ 433.036738 192.2
[M+H-H2O]+ 377.070840 179.0
[M+HCOO]- 439.071781 204.2
[M+CH3COO]- 453.087431 198.1
[M+Na-2H]- 415.048246 197.0
[M]+ 394.07303142 192.1
[M]- 394.07412858 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.