CID 215744

N-(1-(2-(diethylamino)ethyl)-1h-indazol-5-yl)-3,4,5-trimethoxybenzamide monohydrochloride

Structural Information

Molecular Formula
C23H30N4O4
SMILES
CCN(CC)CCN1C2=C(C=C(C=C2)NC(=O)C3=CC(=C(C(=C3)OC)OC)OC)C=N1
InChI
InChI=1S/C23H30N4O4/c1-6-26(7-2)10-11-27-19-9-8-18(12-17(19)15-24-27)25-23(28)16-13-20(29-3)22(31-5)21(14-16)30-4/h8-9,12-15H,6-7,10-11H2,1-5H3,(H,25,28)
InChIKey
UJRYHEUQASMYKQ-UHFFFAOYSA-N
Compound name
N-[1-[2-(diethylamino)ethyl]indazol-5-yl]-3,4,5-trimethoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

426.2267 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 427.23398 204.9
[M+Na]+ 449.21592 216.5
[M+NH4]+ 444.26052 209.8
[M+K]+ 465.18986 212.0
[M-H]- 425.21942 208.2
[M+Na-2H]- 447.20137 209.9
[M]+ 426.22615 207.3
[M]- 426.22725 207.3
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.