CID 5279697

6-methyl-2-[[2-[2-(m-tolyl)ethylamino]benzimidazol-1-yl]methyl]pyridin-3-ol

Structural Information

Molecular Formula
C23H24N4O
SMILES
CC1=CC(=CC=C1)CCNC2=NC3=CC=CC=C3N2CC4=C(C=CC(=N4)C)O
InChI
InChI=1S/C23H24N4O/c1-16-6-5-7-18(14-16)12-13-24-23-26-19-8-3-4-9-21(19)27(23)15-20-22(28)11-10-17(2)25-20/h3-11,14,28H,12-13,15H2,1-2H3,(H,24,26)
InChIKey
RVKYXWHLSLKPLI-UHFFFAOYSA-N
Compound name
6-methyl-2-[[2-[2-(3-methylphenyl)ethylamino]benzimidazol-1-yl]methyl]pyridin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

372.195 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 373.20228 192.4
[M+Na]+ 395.18422 201.6
[M-H]- 371.18772 198.7
[M+NH4]+ 390.22882 202.5
[M+K]+ 411.15816 193.3
[M+H-H2O]+ 355.19226 181.1
[M+HCOO]- 417.19320 212.4
[M+CH3COO]- 431.20885 201.9
[M+Na-2H]- 393.16967 195.6
[M]+ 372.19445 195.1
[M]- 372.19555 195.1
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.