CID 3024898

2-thiazolamine, 4-(4-methoxyphenyl)-5-(4-pyridinyl)-

Structural Information

Molecular Formula
C15H13N3OS
SMILES
COC1=CC=C(C=C1)C2=C(SC(=N2)N)C3=CC=NC=C3
InChI
InChI=1S/C15H13N3OS/c1-19-12-4-2-10(3-5-12)13-14(20-15(16)18-13)11-6-8-17-9-7-11/h2-9H,1H3,(H2,16,18)
InChIKey
ZTZJAIKFRGLHGB-UHFFFAOYSA-N
Compound name
4-(4-methoxyphenyl)-5-pyridin-4-yl-1,3-thiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

283.07794 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.085216 162.5
[M+Na]+ 306.067158 172.7
[M-H]- 282.070664 170.4
[M+NH4]+ 301.111763 177.8
[M+K]+ 322.041098 166.8
[M+H-H2O]+ 266.075200 153.9
[M+HCOO]- 328.076141 182.0
[M+CH3COO]- 342.091791 174.8
[M+Na-2H]- 304.052606 164.4
[M]+ 283.07739142 164.6
[M]- 283.07848858 164.6
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

patents stripe