CID 16074310

N6-(1h-indazol-6-yl)-n2,n4-diisopropyl-1-methoxy-2h-1,3,5-triazine-2,4,6-triamine

Structural Information

Molecular Formula
C17H26N8O
SMILES
CC(C)NC1N=C(N=C(N1OC)NC2=CC3=C(C=C2)C=NN3)NC(C)C
InChI
InChI=1S/C17H26N8O/c1-10(2)19-15-22-16(20-11(3)4)25(26-5)17(23-15)21-13-7-6-12-9-18-24-14(12)8-13/h6-11,16,20H,1-5H3,(H,18,24)(H2,19,21,22,23)
InChIKey
AUCVZGUXNFUWHZ-UHFFFAOYSA-N
Compound name
6-N-(1H-indazol-6-yl)-1-methoxy-2-N,4-N-di(propan-2-yl)-2H-1,3,5-triazine-2,4,6-triamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

358.22296 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 359.23024 186.7
[M+Na]+ 381.21218 193.3
[M-H]- 357.21568 187.7
[M+NH4]+ 376.25678 194.4
[M+K]+ 397.18612 188.1
[M+H-H2O]+ 341.22022 175.8
[M+HCOO]- 403.22116 203.9
[M+CH3COO]- 417.23681 222.5
[M+Na-2H]- 379.19763 190.5
[M]+ 358.22241 187.0
[M]- 358.22351 187.0
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.