CID 191117

2-piperazino-4-thiomorpholinopyrido(3,2-d)pyrimidine maleate

Structural Information

Molecular Formula
C15H20N6S
SMILES
C1CN(CCN1)C2=NC3=C(C(=N2)N4CCSCC4)N=CC=C3
InChI
InChI=1S/C15H20N6S/c1-2-12-13(17-3-1)14(20-8-10-22-11-9-20)19-15(18-12)21-6-4-16-5-7-21/h1-3,16H,4-11H2
InChIKey
GFQUZNPDGPMMFZ-UHFFFAOYSA-N
Compound name
4-(2-piperazin-1-ylpyrido[3,2-d]pyrimidin-4-yl)thiomorpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

316.147 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 317.15428 171.9
[M+Na]+ 339.13622 185.5
[M+NH4]+ 334.18082 179.3
[M+K]+ 355.11016 176.0
[M-H]- 315.13972 175.4
[M+Na-2H]- 337.12167 179.0
[M]+ 316.14645 175.1
[M]- 316.14755 175.1
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

patents stripe