CID 3050165

Compound 776-285

Structural Information

Molecular Formula
C25H28N4O
SMILES
C1CN(CCN1CCNC2=CC=CC=C2C(=O)NC3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C25H28N4O/c30-25(27-21-9-3-1-4-10-21)23-13-7-8-14-24(23)26-15-16-28-17-19-29(20-18-28)22-11-5-2-6-12-22/h1-14,26H,15-20H2,(H,27,30)
InChIKey
MPXDJKFPLJPBNJ-UHFFFAOYSA-N
Compound name
N-phenyl-2-[2-(4-phenylpiperazin-1-yl)ethylamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

400.22632 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 401.23360 201.5
[M+Na]+ 423.21554 215.2
[M+NH4]+ 418.26014 208.7
[M+K]+ 439.18948 205.5
[M-H]- 399.21904 210.2
[M+Na-2H]- 421.20099 212.8
[M]+ 400.22577 205.9
[M]- 400.22687 205.9
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