CID 1906138

3-[(z)-(3-cyclohexyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-(4-methyl-1-piperidinyl)-4h-pyrido[1,2-a]pyrimidin-4-one

Structural Information

Molecular Formula
C24H28N4O2S2
SMILES
CC1CCN(CC1)C2=C(C(=O)N3C=CC=CC3=N2)/C=C\4/C(=O)N(C(=S)S4)C5CCCCC5
InChI
InChI=1S/C24H28N4O2S2/c1-16-10-13-26(14-11-16)21-18(22(29)27-12-6-5-9-20(27)25-21)15-19-23(30)28(24(31)32-19)17-7-3-2-4-8-17/h5-6,9,12,15-17H,2-4,7-8,10-11,13-14H2,1H3/b19-15-
InChIKey
JOKRYEUUDUMLGN-CYVLTUHYSA-N
Compound name
(5Z)-3-cyclohexyl-5-[[2-(4-methylpiperidin-1-yl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

468.16537 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 469.17265 207.4
[M+Na]+ 491.15459 219.5
[M+NH4]+ 486.19919 214.1
[M+K]+ 507.12853 209.5
[M-H]- 467.15809 212.8
[M+Na-2H]- 489.14004 211.8
[M]+ 468.16482 211.4
[M]- 468.16592 211.4
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.

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No patent data available for this compound.