CID 490815

1-cyclohexyl-2-(3-furyl)-n-(4-piperidyl)benzimidazole-5-carboxamide

Structural Information

Molecular Formula
C23H28N4O2
SMILES
C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)NC4CCNCC4)N=C2C5=COC=C5
InChI
InChI=1S/C23H28N4O2/c28-23(25-18-8-11-24-12-9-18)16-6-7-21-20(14-16)26-22(17-10-13-29-15-17)27(21)19-4-2-1-3-5-19/h6-7,10,13-15,18-19,24H,1-5,8-9,11-12H2,(H,25,28)
InChIKey
ZZAGSXSIAXQFQK-UHFFFAOYSA-N
Compound name
1-cyclohexyl-2-(furan-3-yl)-N-piperidin-4-ylbenzimidazole-5-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

392.22122 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 393.22850 191.1
[M+Na]+ 415.21044 193.6
[M-H]- 391.21394 199.1
[M+NH4]+ 410.25504 199.2
[M+K]+ 431.18438 188.2
[M+H-H2O]+ 375.21848 180.0
[M+HCOO]- 437.21942 203.4
[M+CH3COO]- 451.23507 198.0
[M+Na-2H]- 413.19589 188.4
[M]+ 392.22067 183.8
[M]- 392.22177 183.8
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.