CID 3041841

6h-imidazo(4,5-g)benzothiazole, 2-amino-6-(2-morpholinoethyl)-, hydrochloride (2:5)

Structural Information

Molecular Formula
C14H17N5OS
SMILES
C1COCCN1CCN2C=NC3=C2C=CC4=C3SC(=N4)N
InChI
InChI=1S/C14H17N5OS/c15-14-17-10-1-2-11-12(13(10)21-14)16-9-19(11)4-3-18-5-7-20-8-6-18/h1-2,9H,3-8H2,(H2,15,17)
InChIKey
DIYYYZYZCKUUOL-UHFFFAOYSA-N
Compound name
6-(2-morpholin-4-ylethyl)imidazo[4,5-g][1,3]benzothiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

303.1154 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 304.122676 164.7
[M+Na]+ 326.104618 176.2
[M-H]- 302.108124 169.6
[M+NH4]+ 321.149223 179.5
[M+K]+ 342.078558 171.8
[M+H-H2O]+ 286.112660 157.1
[M+HCOO]- 348.113601 179.1
[M+CH3COO]- 362.129251 176.3
[M+Na-2H]- 324.090066 166.9
[M]+ 303.11485142 168.3
[M]- 303.11594858 168.3
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.