CID 3021552

Benzamide, n-(4-((4-(4-methylphenyl)-1-piperazinyl)carbonyl)phenyl)-

Structural Information

Molecular Formula
C25H25N3O2
SMILES
CC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4
InChI
InChI=1S/C25H25N3O2/c1-19-7-13-23(14-8-19)27-15-17-28(18-16-27)25(30)21-9-11-22(12-10-21)26-24(29)20-5-3-2-4-6-20/h2-14H,15-18H2,1H3,(H,26,29)
InChIKey
NXAFNCUVBDWCLL-UHFFFAOYSA-N
Compound name
N-[4-[4-(4-methylphenyl)piperazine-1-carbonyl]phenyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

399.19467 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 400.20195 199.2
[M+Na]+ 422.18389 213.7
[M+NH4]+ 417.22849 206.0
[M+K]+ 438.15783 205.1
[M-H]- 398.18739 206.9
[M+Na-2H]- 420.16934 209.8
[M]+ 399.19412 203.4
[M]- 399.19522 203.4
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.