CID 5276245

5-(2-anilinothiazol-5-yl)-2-hydroxy-benzamide

Structural Information

Molecular Formula
C16H13N3O2S
SMILES
C1=CC=C(C=C1)NC2=NC=C(S2)C3=CC(=C(C=C3)O)C(=O)N
InChI
InChI=1S/C16H13N3O2S/c17-15(21)12-8-10(6-7-13(12)20)14-9-18-16(22-14)19-11-4-2-1-3-5-11/h1-9,20H,(H2,17,21)(H,18,19)
InChIKey
NXPAXEYQPWQCDK-UHFFFAOYSA-N
Compound name
5-(2-anilino-1,3-thiazol-5-yl)-2-hydroxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

311.07285 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 312.08013 168.6
[M+Na]+ 334.06207 176.4
[M-H]- 310.06557 176.3
[M+NH4]+ 329.10667 182.6
[M+K]+ 350.03601 170.3
[M+H-H2O]+ 294.07011 160.4
[M+HCOO]- 356.07105 187.7
[M+CH3COO]- 370.08670 179.6
[M+Na-2H]- 332.04752 169.7
[M]+ 311.07230 168.2
[M]- 311.07340 168.2
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.