CID 7465153

2-(4-benzyl-1-piperazinyl)-n'-(1-(4-chlorophenyl)ethylidene)acetohydrazide

Structural Information

Molecular Formula
C21H25ClN4O
SMILES
C/C(=N\NC(=O)CN1CCN(CC1)CC2=CC=CC=C2)/C3=CC=C(C=C3)Cl
InChI
InChI=1S/C21H25ClN4O/c1-17(19-7-9-20(22)10-8-19)23-24-21(27)16-26-13-11-25(12-14-26)15-18-5-3-2-4-6-18/h2-10H,11-16H2,1H3,(H,24,27)/b23-17+
InChIKey
BMWYYDRXLYNYSD-HAVVHWLPSA-N
Compound name
2-(4-benzylpiperazin-1-yl)-N-[(E)-1-(4-chlorophenyl)ethylideneamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

384.1717 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 385.17898 193.3
[M+Na]+ 407.16092 196.3
[M-H]- 383.16442 199.7
[M+NH4]+ 402.20552 202.1
[M+K]+ 423.13486 189.9
[M+H-H2O]+ 367.16896 181.7
[M+HCOO]- 429.16990 207.1
[M+CH3COO]- 443.18555 224.2
[M+Na-2H]- 405.14637 194.5
[M]+ 384.17115 191.1
[M]- 384.17225 191.1
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.