CID 73331364

N-(1-{[4-(trifluoromethyl)phenyl]methyl}-1h-indazol-3-yl)furan-2-carboxamide

Structural Information

Molecular Formula
C20H14F3N3O2
SMILES
C1=CC=C2C(=C1)C(=NN2CC3=CC=C(C=C3)C(F)(F)F)NC(=O)C4=CC=CO4
InChI
InChI=1S/C20H14F3N3O2/c21-20(22,23)14-9-7-13(8-10-14)12-26-16-5-2-1-4-15(16)18(25-26)24-19(27)17-6-3-11-28-17/h1-11H,12H2,(H,24,25,27)
InChIKey
LWBFIOPAFDTCND-UHFFFAOYSA-N
Compound name
N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

56
Patents

385.10382 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 386.11110 186.6
[M+Na]+ 408.09304 197.2
[M+NH4]+ 403.13764 191.1
[M+K]+ 424.06698 194.8
[M-H]- 384.09654 187.7
[M+Na-2H]- 406.07849 192.3
[M]+ 385.10327 188.2
[M]- 385.10437 188.2
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