CID 14014892

10-(2-(4-methyl-1-piperazinyl)ethyl)-9(10h)-acridinone (4,5-dihydro-2-thiazolyl)hydrazone

Structural Information

Molecular Formula
C23H28N6S
SMILES
CN1CCN(CC1)CCN2C3=CC=CC=C3C(=NNC4=NCCS4)C5=CC=CC=C52
InChI
InChI=1S/C23H28N6S/c1-27-11-13-28(14-12-27)15-16-29-20-8-4-2-6-18(20)22(19-7-3-5-9-21(19)29)25-26-23-24-10-17-30-23/h2-9H,10-17H2,1H3,(H,24,26)
InChIKey
UDJHKYFSPINRQQ-UHFFFAOYSA-N
Compound name
N-[[10-[2-(4-methylpiperazin-1-yl)ethyl]acridin-9-ylidene]amino]-4,5-dihydro-1,3-thiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

5
Patents

420.20963 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 421.21691 197.4
[M+Na]+ 443.19885 211.9
[M+NH4]+ 438.24345 205.7
[M+K]+ 459.17279 201.9
[M-H]- 419.20235 204.6
[M+Na-2H]- 441.18430 205.9
[M]+ 420.20908 201.9
[M]- 420.21018 201.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe